BindingDB logo
myBDB logout

PubChem AID 1890

Compile data set for download or QSAR
Found 101 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
3C-like protease


(Avian infectious bronchitis virus)
BDBM32834
PNG
((4-methoxyphenyl)-(2-methylsulfanyl-6,7-dihydro-[1...)
Show SMILES COc1ccc(cc1)C(=O)n1c(SC)nc2cc3OCCOc3cc12
Show InChI InChI=1S/C18H16N2O4S/c1-22-12-5-3-11(4-6-12)17(21)20-14-10-16-15(23-7-8-24-16)9-13(14)19-18(20)25-2/h3-6,9-10H,7-8H2,1-2H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.09E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47919
PNG
(Furan-2-carboxylic acid (4-sec-butyl-phenyl)-(cycl...)
Show SMILES CCC(C)c1ccc(cc1)N(C(C(=O)NC1CCCC1)c1cccnc1)C(=O)c1ccco1
Show InChI InChI=1S/C27H31N3O3/c1-3-19(2)20-12-14-23(15-13-20)30(27(32)24-11-7-17-33-24)25(21-8-6-16-28-18-21)26(31)29-22-9-4-5-10-22/h6-8,11-19,22,25H,3-5,9-10H2,1-2H3,(H,29,31)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.23E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47908
PNG
(2-chloranyl-1-[3-(3,4-dimethoxyphenyl)-5-thiophen-...)
Show SMILES COc1ccc(cc1OC)C1CC(=NN1C(=O)CCl)c1cccs1
Show InChI InChI=1S/C17H17ClN2O3S/c1-22-14-6-5-11(8-15(14)23-2)13-9-12(16-4-3-7-24-16)19-20(13)17(21)10-18/h3-8,13H,9-10H2,1-2H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.30E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47907
PNG
(1-[3-[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]-...)
Show SMILES COc1cc(ccc1OC(F)F)C1CC(=NN1C(=O)CCl)c1cccs1
Show InChI InChI=1S/C17H15ClF2N2O3S/c1-24-14-7-10(4-5-13(14)25-17(19)20)12-8-11(15-3-2-6-26-15)21-22(12)16(23)9-18/h2-7,12,17H,8-9H2,1H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.80E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47851
PNG
(2-(N-[2-(1-benzotriazolyl)-1-oxoethyl]-2,4,6-trime...)
Show SMILES Cc1cc(C)c(N(C(C(=O)NC(C)(C)C)c2ccsc2)C(=O)Cn2nnc3ccccc23)c(C)c1
Show InChI InChI=1S/C27H31N5O2S/c1-17-13-18(2)24(19(3)14-17)32(23(33)15-31-22-10-8-7-9-21(22)29-30-31)25(20-11-12-35-16-20)26(34)28-27(4,5)6/h7-14,16,25H,15H2,1-6H3,(H,28,34)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 2.90E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47916
PNG
((4-ethyl-2-oxidanylidene-chromen-7-yl) furan-2-car...)
Show SMILES CCc1cc(=O)oc2cc(OC(=O)c3ccco3)ccc12
Show InChI InChI=1S/C16H12O5/c1-2-10-8-15(17)21-14-9-11(5-6-12(10)14)20-16(18)13-4-3-7-19-13/h3-9H,2H2,1H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.96E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM32909
PNG
((4-methyl-2-oxidanylidene-chromen-7-yl) furan-2-ca...)
Show SMILES Cc1cc(=O)oc2cc(OC(=O)c3ccco3)ccc12
Show InChI InChI=1S/C15H10O5/c1-9-7-14(16)20-13-8-10(4-5-11(9)13)19-15(17)12-3-2-6-18-12/h2-8H,1H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 3.34E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47911
PNG
(2-chloranyl-1-[(3Z)-3-indol-3-ylidene-5-(4-methoxy...)
Show SMILES COc1ccc(cc1)C1N(NC(C1=O)c1c[nH]c2ccccc12)C(=O)CCl
Show InChI InChI=1S/C20H18ClN3O3/c1-27-13-8-6-12(7-9-13)19-20(26)18(23-24(19)17(25)10-21)15-11-22-16-5-3-2-4-14(15)16/h2-9,11,18-19,22-23H,10H2,1H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 3.58E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47874
PNG
(2-keto-N-[2-(2-methoxyphenoxy)ethyl]-1H-quinoline-...)
Show SMILES COc1ccccc1OCCNC(=O)c1cc(=O)[nH]c2ccccc12
Show InChI InChI=1S/C19H18N2O4/c1-24-16-8-4-5-9-17(16)25-11-10-20-19(23)14-12-18(22)21-15-7-3-2-6-13(14)15/h2-9,12H,10-11H2,1H3,(H,20,23)(H,21,22)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 3.60E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47862
PNG
(2-(1-benzotriazolyl)-1-(4-bromophenyl)ethanone | 2...)
Show SMILES Brc1ccc(cc1)C(=O)Cn1nnc2ccccc12
Show InChI InChI=1S/C14H10BrN3O/c15-11-7-5-10(6-8-11)14(19)9-18-13-4-2-1-3-12(13)16-17-18/h1-8H,9H2
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 4.01E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47893
PNG
(2-chloranyl-1-[3-(4-methylphenyl)-5-thiophen-2-yl-...)
Show SMILES Cc1ccc(cc1)C1CC(=NN1C(=O)CCl)c1cccs1
Show InChI InChI=1S/C16H15ClN2OS/c1-11-4-6-12(7-5-11)14-9-13(15-3-2-8-21-15)18-19(14)16(20)10-17/h2-8,14H,9-10H2,1H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 4.19E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47887
PNG
(2-Chloro-1-[4-(2-ethyl-7-methyl-5,6,7,8-tetrahydro...)
Show SMILES CCc1nc(N2CCN(CC2)C(=O)CCl)c2c3CCC(C)Cc3sc2n1
Show InChI InChI=1S/C19H25ClN4OS/c1-3-15-21-18(24-8-6-23(7-9-24)16(25)11-20)17-13-5-4-12(2)10-14(13)26-19(17)22-15/h12H,3-11H2,1-2H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 4.23E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47889
PNG
(1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-5-ethox...)
Show SMILES CCOc1ccc2N(CC3COc4ccccc4O3)C(=O)C(=O)c2c1
Show InChI InChI=1S/C19H17NO5/c1-2-23-12-7-8-15-14(9-12)18(21)19(22)20(15)10-13-11-24-16-5-3-4-6-17(16)25-13/h3-9,13H,2,10-11H2,1H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 4.29E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47870
PNG
(2-chloranyl-1-[2,5-dimethyl-1-(3-nitrophenyl)pyrro...)
Show SMILES Cc1cc(C(=O)CCl)c(C)n1-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C14H13ClN2O3/c1-9-6-13(14(18)8-15)10(2)16(9)11-4-3-5-12(7-11)17(19)20/h3-7H,8H2,1-2H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 4.59E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47843
PNG
(1-(5-phenyl-2-pyrrolidin-1-yl-1H-pyrrol-3-yl)ethan...)
Show SMILES CC(=O)c1cc([nH]c1N1CCCC1)-c1ccccc1
Show InChI InChI=1S/C16H18N2O/c1-12(19)14-11-15(13-7-3-2-4-8-13)17-16(14)18-9-5-6-10-18/h2-4,7-8,11,17H,5-6,9-10H2,1H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 4.63E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47848
PNG
(4-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-...)
Show SMILES Cc1cc(C)c(C)c(c1C)S(=O)(=O)N1CCN(CC1)C(=O)c1cc(=O)[nH]c2ccccc12
Show InChI InChI=1S/C24H27N3O4S/c1-15-13-16(2)18(4)23(17(15)3)32(30,31)27-11-9-26(10-12-27)24(29)20-14-22(28)25-21-8-6-5-7-19(20)21/h5-8,13-14H,9-12H2,1-4H3,(H,25,28)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 4.83E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47926
PNG
(2-(3-amino-3-oxopropyl)-3-(4-chlorobenzoyl)-2H-ind...)
Show SMILES NC(=O)CCn1c(C(=O)c2ccc(Cl)cc2)c2ccccc2[n+]1[O-]
Show InChI InChI=1S/C17H14ClN3O3/c18-12-7-5-11(6-8-12)17(23)16-13-3-1-2-4-14(13)21(24)20(16)10-9-15(19)22/h1-8H,9-10H2,(H2,19,22)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 4.88E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47871
PNG
(4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]car...)
Show SMILES FC(F)(F)c1cccc(c1)N1CCN(CC1)C(=O)c1cc(=O)[nH]c2ccccc12
Show InChI InChI=1S/C21H18F3N3O2/c22-21(23,24)14-4-3-5-15(12-14)26-8-10-27(11-9-26)20(29)17-13-19(28)25-18-7-2-1-6-16(17)18/h1-7,12-13H,8-11H2,(H,25,28)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 5.10E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47858
PNG
(2-(1-benzotriazolyl)-N-[(3,4,5-trimethoxyphenyl)me...)
Show SMILES COc1cc(C=NNC(=O)Cn2nnc3ccccc23)cc(OC)c1OC
Show InChI InChI=1S/C18H19N5O4/c1-25-15-8-12(9-16(26-2)18(15)27-3)10-19-21-17(24)11-23-14-7-5-4-6-13(14)20-22-23/h4-10H,11H2,1-3H3,(H,21,24)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 5.18E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47905
PNG
(2-chloranyl-1-[3-(furan-2-yl)-5-(5-methylfuran-2-y...)
Show SMILES Cc1ccc(o1)C1=NN(C(C1)c1ccco1)C(=O)CCl
Show InChI InChI=1S/C14H13ClN2O3/c1-9-4-5-12(20-9)10-7-11(13-3-2-6-19-13)17(16-10)14(18)8-15/h2-6,11H,7-8H2,1H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 5.20E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47546
PNG
(2-[[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]-4-...)
Show SMILES OC(=O)c1c(NC(=O)\C=C\c2cccs2)scc1-c1ccccc1
Show InChI InChI=1S/C18H13NO3S2/c20-15(9-8-13-7-4-10-23-13)19-17-16(18(21)22)14(11-24-17)12-5-2-1-3-6-12/h1-11H,(H,19,20)(H,21,22)/b9-8+
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Patents


Similars

PCBioAssay
n/an/a 5.22E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47918
PNG
(2-furancarboxylic acid [4-chloro-2-(5-methyl-1,3-d...)
Show SMILES CC1CCc2c(O)n(c(O)c2C1)-c1cc(Cl)ccc1OC(=O)c1ccco1
Show InChI InChI=1S/C20H18ClNO5/c1-11-4-6-13-14(9-11)19(24)22(18(13)23)15-10-12(21)5-7-16(15)27-20(25)17-3-2-8-26-17/h2-3,5,7-8,10-11,23-24H,4,6,9H2,1H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 5.40E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47921
PNG
(Furan-2-carboxylic acid (cyclopentylcarbamoyl-pyri...)
Show SMILES CC(C)c1ccc(cc1)N(C(C(=O)NC1CCCC1)c1cccnc1)C(=O)c1ccco1
Show InChI InChI=1S/C26H29N3O3/c1-18(2)19-11-13-22(14-12-19)29(26(31)23-10-6-16-32-23)24(20-7-5-15-27-17-20)25(30)28-21-8-3-4-9-21/h5-7,10-18,21,24H,3-4,8-9H2,1-2H3,(H,28,30)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 5.93E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47863
PNG
(2-(4-acetamido-N-[2-(1-benzotriazolyl)-1-oxoethyl]...)
Show SMILES CCC(C)(C)NC(=O)C(N(C(=O)Cn1nnc2ccccc12)c1ccc(NC(C)=O)cc1)c1cccn1C
Show InChI InChI=1S/C28H33N7O3/c1-6-28(3,4)30-27(38)26(24-12-9-17-33(24)5)35(21-15-13-20(14-16-21)29-19(2)36)25(37)18-34-23-11-8-7-10-22(23)31-32-34/h7-17,26H,6,18H2,1-5H3,(H,29,36)(H,30,38)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem

Similars

PCBioAssay
n/an/a 6.29E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47838
PNG
(4-chlorobenzoic acid 3-pyridinyl ester;hydrochlori...)
Show SMILES Clc1ccc(cc1)C(=O)Oc1cccnc1
Show InChI InChI=1S/C12H8ClNO2/c13-10-5-3-9(4-6-10)12(15)16-11-2-1-7-14-8-11/h1-8H
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 6.31E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47890
PNG
(MLS001215951 | N-[5-ethyl-1-(2-morpholin-4-ylethyl...)
Show SMILES CCc1ccc2N(CCN3CCOCC3)C(=O)C(NC(C)=O)c2c1
Show InChI InChI=1S/C18H25N3O3/c1-3-14-4-5-16-15(12-14)17(19-13(2)22)18(23)21(16)7-6-20-8-10-24-11-9-20/h4-5,12,17H,3,6-11H2,1-2H3,(H,19,22)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 6.56E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47872
PNG
(4-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-1...)
Show SMILES Cc1cccc(N2CCN(CC2)C(=O)c2cc(=O)[nH]c3ccccc23)c1C
Show InChI InChI=1S/C22H23N3O2/c1-15-6-5-9-20(16(15)2)24-10-12-25(13-11-24)22(27)18-14-21(26)23-19-8-4-3-7-17(18)19/h3-9,14H,10-13H2,1-2H3,(H,23,26)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 6.66E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47913
PNG
(MLS001030320 | N-(4-nitro-1,2,5-oxadiazol-3-yl)-2-...)
Show SMILES [O-][N+](=O)c1nonc1NC(=O)CSc1ccccn1
Show InChI InChI=1S/C9H7N5O4S/c15-6(5-19-7-3-1-2-4-10-7)11-8-9(14(16)17)13-18-12-8/h1-4H,5H2,(H,11,12,15)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 7.07E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47857
PNG
(2-furancarboxylic acid [4-bromo-2-[(E)-3-(2-fluoro...)
Show SMILES Fc1ccccc1\C=C\C(=O)c1cc(Br)ccc1OC(=O)c1ccco1
Show InChI InChI=1S/C20H12BrFO4/c21-14-8-10-18(26-20(24)19-6-3-11-25-19)15(12-14)17(23)9-7-13-4-1-2-5-16(13)22/h1-12H/b9-7+
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 7.12E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47866
PNG
(1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolecarboxa...)
Show SMILES O=Cc1cn(Cc2ccccc2)nc1-c1cccnc1
Show InChI InChI=1S/C16H13N3O/c20-12-15-11-19(10-13-5-2-1-3-6-13)18-16(15)14-7-4-8-17-9-14/h1-9,11-12H,10H2
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 7.21E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47892
PNG
(MLS001215987 | N-[5-bromanyl-1-(2-morpholin-4-ylet...)
Show SMILES CC(=O)NC1C(=O)N(CCN2CCOCC2)c2ccc(Br)cc12
Show InChI InChI=1S/C16H20BrN3O3/c1-11(21)18-15-13-10-12(17)2-3-14(13)20(16(15)22)5-4-19-6-8-23-9-7-19/h2-3,10,15H,4-9H2,1H3,(H,18,21)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 7.58E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47845
PNG
(2-[(2-Benzotriazol-1-yl-acetyl)-furan-2-ylmethyl-a...)
Show SMILES COc1cccc(c1)C(N(Cc1ccco1)C(=O)Cn1nnc2ccccc12)C(=O)NCc1ccco1
Show InChI InChI=1S/C27H25N5O5/c1-35-20-8-4-7-19(15-20)26(27(34)28-16-21-9-5-13-36-21)31(17-22-10-6-14-37-22)25(33)18-32-24-12-3-2-11-23(24)29-30-32/h2-15,26H,16-18H2,1H3,(H,28,34)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 7.76E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47850
PNG
(1-(N-[2-(1-benzotriazolyl)-1-oxoethyl]-4-methoxyan...)
Show SMILES COc1ccc(cc1)N(C(=O)Cn1nnc2ccccc12)C1(CCCCC1)C(=O)NC1CCCC1
Show InChI InChI=1S/C27H33N5O3/c1-35-22-15-13-21(14-16-22)32(25(33)19-31-24-12-6-5-11-23(24)29-30-31)27(17-7-2-8-18-27)26(34)28-20-9-3-4-10-20/h5-6,11-16,20H,2-4,7-10,17-19H2,1H3,(H,28,34)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 7.89E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47855
PNG
(2-furancarboxylic acid [4-bromo-2-[(E)-3-(2-methox...)
Show SMILES COc1ccccc1\C=C\C(=O)c1cc(Br)ccc1OC(=O)c1ccco1
Show InChI InChI=1S/C21H15BrO5/c1-25-18-6-3-2-5-14(18)8-10-17(23)16-13-15(22)9-11-19(16)27-21(24)20-7-4-12-26-20/h2-13H,1H3/b10-8+
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 8.94E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47895
PNG
(MLS001215963 | N-[5-fluoranyl-1-(2-morpholin-4-yle...)
Show SMILES CC(=O)NC1C(=O)N(CCN2CCOCC2)c2ccc(F)cc12
Show InChI InChI=1S/C16H20FN3O3/c1-11(21)18-15-13-10-12(17)2-3-14(13)20(16(15)22)5-4-19-6-8-23-9-7-19/h2-3,10,15H,4-9H2,1H3,(H,18,21)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 9.10E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47923
PNG
(2-(4-acetamido-N-[2-(1-benzotriazolyl)-1-oxoethyl]...)
Show SMILES COc1ccc(cc1)C(N(C(=O)Cn1nnc2ccccc12)c1ccc(NC(C)=O)cc1)C(=O)NCC1CCCO1
Show InChI InChI=1S/C30H32N6O5/c1-20(37)32-22-11-13-23(14-12-22)36(28(38)19-35-27-8-4-3-7-26(27)33-34-35)29(21-9-15-24(40-2)16-10-21)30(39)31-18-25-6-5-17-41-25/h3-4,7-16,25,29H,5-6,17-19H2,1-2H3,(H,31,39)(H,32,37)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 9.35E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47924
PNG
(2-(3-amino-3-oxopropyl)-3-(4-methylbenzoyl)-2H-ind...)
Show SMILES Cc1ccc(cc1)C(=O)c1n(CCC(N)=O)[n+]([O-])c2ccccc12
Show InChI InChI=1S/C18H17N3O3/c1-12-6-8-13(9-7-12)18(23)17-14-4-2-3-5-15(14)21(24)20(17)11-10-16(19)22/h2-9H,10-11H2,1H3,(H2,19,22)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 9.36E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47901
PNG
((5E)-1-(2-fluorophenyl)-5-(1H-indol-3-ylmethylene)...)
Show SMILES Fc1ccccc1N1C(=O)NC(=O)C(=Cc2c[nH]c3ccccc23)C1=O
Show InChI InChI=1S/C19H12FN3O3/c20-14-6-2-4-8-16(14)23-18(25)13(17(24)22-19(23)26)9-11-10-21-15-7-3-1-5-12(11)15/h1-10,21H,(H,22,24,26)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 9.47E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47909
PNG
(1-(N-(2-chloro-1-oxoethyl)anilino)-3-phenylurea | ...)
Show SMILES ClCC(=O)N(NC(=O)Nc1ccccc1)c1ccccc1
Show InChI InChI=1S/C15H14ClN3O2/c16-11-14(20)19(13-9-5-2-6-10-13)18-15(21)17-12-7-3-1-4-8-12/h1-10H,11H2,(H2,17,18,21)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 9.64E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47891
PNG
(1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-5-metho...)
Show SMILES COc1ccc2N(CC3COc4ccccc4O3)C(=O)C(=O)c2c1
Show InChI InChI=1S/C18H15NO5/c1-22-11-6-7-14-13(8-11)17(20)18(21)19(14)9-12-10-23-15-4-2-3-5-16(15)24-12/h2-8,12H,9-10H2,1H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 9.74E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47925
PNG
(3-(4-amino-3,5-dichlorobenzoyl)-2-(3-amino-3-oxopr...)
Show SMILES NC(=O)CCn1c(C(=O)c2cc(Cl)c(N)c(Cl)c2)c2ccccc2[n+]1[O-]
Show InChI InChI=1S/C17H14Cl2N4O3/c18-11-7-9(8-12(19)15(11)21)17(25)16-10-3-1-2-4-13(10)23(26)22(16)6-5-14(20)24/h1-4,7-8H,5-6,21H2,(H2,20,24)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 9.81E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47900
PNG
(1-(5-bromo-2-fluorophenyl)-2-(chloroacetyl)-6,7-di...)
Show SMILES COc1cc2CCN(C(c3cc(Br)ccc3F)c2cc1OC)C(=O)CCl
Show InChI InChI=1S/C19H18BrClFNO3/c1-25-16-7-11-5-6-23(18(24)10-21)19(13(11)9-17(16)26-2)14-8-12(20)3-4-15(14)22/h3-4,7-9,19H,5-6,10H2,1-2H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 9.88E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47859
PNG
(2-(1-benzotriazolyl)-1-(4-chlorophenyl)ethanone | ...)
Show SMILES Clc1ccc(cc1)C(=O)Cn1nnc2ccccc12
Show InChI InChI=1S/C14H10ClN3O/c15-11-7-5-10(6-8-11)14(19)9-18-13-4-2-1-3-12(13)16-17-18/h1-8H,9H2
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 9.91E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47876
PNG
(4-(4-phenylpiperazin-1-yl)carbonyl-1H-quinolin-2-o...)
Show SMILES O=C(N1CCN(CC1)c1ccccc1)c1cc(=O)[nH]c2ccccc12
Show InChI InChI=1S/C20H19N3O2/c24-19-14-17(16-8-4-5-9-18(16)21-19)20(25)23-12-10-22(11-13-23)15-6-2-1-3-7-15/h1-9,14H,10-13H2,(H,21,24)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 9.95E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM37254
PNG
(10-phenothiazinecarbothioic acid S-(5-methyl-1,3,4...)
Show SMILES Cc1nnc(SC(=O)N2c3ccccc3Sc3ccccc23)s1
Show InChI InChI=1S/C16H11N3OS3/c1-10-17-18-15(21-10)23-16(20)19-11-6-2-4-8-13(11)22-14-9-5-3-7-12(14)19/h2-9H,1H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.04E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47852
PNG
(2-[(2-Benzotriazol-1-yl-acetyl)-cyclopropyl-amino]...)
Show SMILES COc1cccc(c1)C(N(C1CC1)C(=O)Cn1nnc2ccccc12)C(=O)Nc1ccc(F)cc1
Show InChI InChI=1S/C26H24FN5O3/c1-35-21-6-4-5-17(15-21)25(26(34)28-19-11-9-18(27)10-12-19)32(20-13-14-20)24(33)16-31-23-8-3-2-7-22(23)29-30-31/h2-12,15,20,25H,13-14,16H2,1H3,(H,28,34)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.05E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47873
PNG
(2-chloranyl-N-(1-ethanoylindol-3-yl)-N-(4-nitrophe...)
Show SMILES CC(=O)n1cc(N(C(=O)CCl)c2ccc(cc2)[N+]([O-])=O)c2ccccc12
Show InChI InChI=1S/C18H14ClN3O4/c1-12(23)20-11-17(15-4-2-3-5-16(15)20)21(18(24)10-19)13-6-8-14(9-7-13)22(25)26/h2-9,11H,10H2,1H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.08E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47875
PNG
(1,5-Diisopropyl-3,7-bis-(2-nitro-benzoyl)-3,7-diaz...)
Show SMILES CC(C)C12CN(CC(CN(C1)C(=O)c1ccccc1[N+]([O-])=O)(C(C)C)C2=O)C(=O)c1ccccc1[N+]([O-])=O
Show InChI InChI=1S/C27H30N4O7/c1-17(2)26-13-28(23(32)19-9-5-7-11-21(19)30(35)36)15-27(18(3)4,25(26)34)16-29(14-26)24(33)20-10-6-8-12-22(20)31(37)38/h5-12,17-18H,13-16H2,1-4H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.11E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47902
PNG
(1-[(2E)-3-phenylprop-2-enyl]-1H-indole-2,3-dione |...)
Show SMILES O=C1N(C\C=C\c2ccccc2)c2ccccc2C1=O
Show InChI InChI=1S/C17H13NO2/c19-16-14-10-4-5-11-15(14)18(17(16)20)12-6-9-13-7-2-1-3-8-13/h1-11H,12H2/b9-6+
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.12E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47922
PNG
(2-(4-acetamido-N-[2-(1-benzotriazolyl)-1-oxoethyl]...)
Show SMILES COc1cccc(c1)C(N(C(=O)Cn1nnc2ccccc12)c1ccc(NC(C)=O)cc1)C(=O)NCC1CCCO1
Show InChI InChI=1S/C30H32N6O5/c1-20(37)32-22-12-14-23(15-13-22)36(28(38)19-35-27-11-4-3-10-26(27)33-34-35)29(21-7-5-8-24(17-21)40-2)30(39)31-18-25-9-6-16-41-25/h3-5,7-8,10-15,17,25,29H,6,9,16,18-19H2,1-2H3,(H,31,39)(H,32,37)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.12E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47853
PNG
(2-furancarboxylic acid [4-bromo-2-[(E)-3-(4-methyl...)
Show SMILES Cc1ccc(\C=C\C(=O)c2cc(Br)ccc2OC(=O)c2ccco2)cc1
Show InChI InChI=1S/C21H15BrO4/c1-14-4-6-15(7-5-14)8-10-18(23)17-13-16(22)9-11-19(17)26-21(24)20-3-2-12-25-20/h2-13H,1H3/b10-8+
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.12E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47844
PNG
(4-chloranyl-N-(1-methylbenzimidazol-5-yl)benzamide...)
Show SMILES Cn1cnc2cc(NC(=O)c3ccc(Cl)cc3)ccc12
Show InChI InChI=1S/C15H12ClN3O/c1-19-9-17-13-8-12(6-7-14(13)19)18-15(20)10-2-4-11(16)5-3-10/h2-9H,1H3,(H,18,20)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.14E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47849
PNG
(2-chloranyl-N-[4,5-dimethyl-3-(phenylcarbonyl)thio...)
Show SMILES Cc1sc(NC(=O)CCl)c(C(=O)c2ccccc2)c1C
Show InChI InChI=1S/C15H14ClNO2S/c1-9-10(2)20-15(17-12(18)8-16)13(9)14(19)11-6-4-3-5-7-11/h3-7H,8H2,1-2H3,(H,17,18)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.16E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47861
PNG
(2-(4-acetamido-N-[2-(1-benzotriazolyl)-1-oxoethyl]...)
Show SMILES CCC(C)(C)NC(=O)C(N(C(=O)Cn1nnc2ccccc12)c1ccc(NC(C)=O)cc1)c1ccc(O)cc1
Show InChI InChI=1S/C29H32N6O4/c1-5-29(3,4)31-28(39)27(20-10-16-23(37)17-11-20)35(22-14-12-21(13-15-22)30-19(2)36)26(38)18-34-25-9-7-6-8-24(25)32-33-34/h6-17,27,37H,5,18H2,1-4H3,(H,30,36)(H,31,39)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.18E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47906
PNG
(MLS001174216 | N-[3-(dimethylsulfamoyl)phenyl]-2-(...)
Show SMILES CN(C)S(=O)(=O)c1cccc(NC(=O)CSc2cccc3cccnc23)c1
Show InChI InChI=1S/C19H19N3O3S2/c1-22(2)27(24,25)16-9-4-8-15(12-16)21-18(23)13-26-17-10-3-6-14-7-5-11-20-19(14)17/h3-12H,13H2,1-2H3,(H,21,23)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.20E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47877
PNG
(1,3-benzothiazole-6-carboxylic acid | MLS001003038...)
Show SMILES OC(=O)c1ccc2ncsc2c1
Show InChI InChI=1S/C8H5NO2S/c10-8(11)5-1-2-6-7(3-5)12-4-9-6/h1-4H,(H,10,11)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Patents


Similars

PCBioAssay
n/an/a 1.21E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47842
PNG
((1-methylbenzimidazol-5-yl) 4-methylbenzoate | 4-m...)
Show SMILES Cc1ccc(cc1)C(=O)Oc1ccc2n(C)cnc2c1
Show InChI InChI=1S/C16H14N2O2/c1-11-3-5-12(6-4-11)16(19)20-13-7-8-15-14(9-13)17-10-18(15)2/h3-10H,1-2H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.28E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47869
PNG
(MLS000771302 | N-(4-bromanyl-3-methyl-phenyl)-2-(6...)
Show SMILES Cc1cc(NC(=O)COn2nnc3ccc(cc23)S(C)(=O)=O)ccc1Br
Show InChI InChI=1S/C16H15BrN4O4S/c1-10-7-11(3-5-13(10)17)18-16(22)9-25-21-15-8-12(26(2,23)24)4-6-14(15)19-20-21/h3-8H,9H2,1-2H3,(H,18,22)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.34E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47886
PNG
(2-Chloro-N-(4-methoxy-phenyl)-N-(2-oxo-1,2-dihydro...)
Show SMILES COc1ccc(cc1)N(Cc1cc(=O)[nH]c2ccccc12)C(=O)CCl
Show InChI InChI=1S/C19H17ClN2O3/c1-25-15-8-6-14(7-9-15)22(19(24)11-20)12-13-10-18(23)21-17-5-3-2-4-16(13)17/h2-10H,11-12H2,1H3,(H,21,23)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.41E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47860
PNG
(2-(4-acetamido-N-[2-(1-benzotriazolyl)-1-oxoethyl]...)
Show SMILES CC(=O)Nc1ccc(cc1)N(C(C(=O)NC1CCCC1)c1ccc(O)c(O)c1)C(=O)Cn1nnc2ccccc12
Show InChI InChI=1S/C29H30N6O5/c1-18(36)30-21-11-13-22(14-12-21)35(27(39)17-34-24-9-5-4-8-23(24)32-33-34)28(19-10-15-25(37)26(38)16-19)29(40)31-20-6-2-3-7-20/h4-5,8-16,20,28,37-38H,2-3,6-7,17H2,1H3,(H,30,36)(H,31,40)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.41E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47883
PNG
(5-bromanyl-N'-[(Z)-(2-oxidanylidenenaphthalen-1-yl...)
Show SMILES Oc1ccc2ccccc2c1C=NNC(=O)c1cncc(Br)c1
Show InChI InChI=1S/C17H12BrN3O2/c18-13-7-12(8-19-9-13)17(23)21-20-10-15-14-4-2-1-3-11(14)5-6-16(15)22/h1-10,22H,(H,21,23)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.44E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47837
PNG
(2-[(2-Benzotriazol-1-yl-acetyl)-indan-5-yl-amino]-...)
Show SMILES O=C(Cn1nnc2ccccc12)N(C(C(=O)NCc1ccco1)c1ccco1)c1ccc2CCCc2c1
Show InChI InChI=1S/C28H25N5O4/c34-26(18-32-24-10-2-1-9-23(24)30-31-32)33(21-13-12-19-6-3-7-20(19)16-21)27(25-11-5-15-37-25)28(35)29-17-22-8-4-14-36-22/h1-2,4-5,8-16,27H,3,6-7,17-18H2,(H,29,35)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.51E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47929
PNG
(2-(3-amino-3-oxopropyl)-3-(3-nitrobenzoyl)-2H-inda...)
Show SMILES NC(=O)CCn1c(C(=O)c2cccc(c2)[N+]([O-])=O)c2ccccc2[n+]1[O-]
Show InChI InChI=1S/C17H14N4O5/c18-15(22)8-9-19-16(13-6-1-2-7-14(13)20(19)24)17(23)11-4-3-5-12(10-11)21(25)26/h1-7,10H,8-9H2,(H2,18,22)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.53E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47865
PNG
((2-oxidanylidene-2-phenothiazin-10-yl-ethyl) pyrid...)
Show SMILES O=C(COC(=O)c1cccnc1)N1c2ccccc2Sc2ccccc12
Show InChI InChI=1S/C20H14N2O3S/c23-19(13-25-20(24)14-6-5-11-21-12-14)22-15-7-1-3-9-17(15)26-18-10-4-2-8-16(18)22/h1-12H,13H2
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.61E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47903
PNG
(2-chloranyl-N,N-bis(2-phenylethyl)ethanamide | 2-c...)
Show SMILES ClCC(=O)N(CCc1ccccc1)CCc1ccccc1
Show InChI InChI=1S/C18H20ClNO/c19-15-18(21)20(13-11-16-7-3-1-4-8-16)14-12-17-9-5-2-6-10-17/h1-10H,11-15H2
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.63E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47899
PNG
(1-(3,4-dimethylbenzoyl)-1H-benzimidazole | 1-benzi...)
Show SMILES Cc1ccc(cc1C)C(=O)n1cnc2ccccc12
Show InChI InChI=1S/C16H14N2O/c1-11-7-8-13(9-12(11)2)16(19)18-10-17-14-5-3-4-6-15(14)18/h3-10H,1-2H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.69E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM40867
PNG
(2-furancarboxylic acid [4-chloro-2-(2,5-dioxo-1-py...)
Show SMILES Oc1ccc(O)n1-c1cc(Cl)ccc1OC(=O)c1ccco1
Show InChI InChI=1S/C15H10ClNO5/c16-9-3-4-11(22-15(20)12-2-1-7-21-12)10(8-9)17-13(18)5-6-14(17)19/h1-8,18-19H
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.84E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47880
PNG
(1-(3-phenylpropyl)indole-2,3-dione | 1-(3-phenylpr...)
Show SMILES O=C1N(CCCc2ccccc2)c2ccccc2C1=O
Show InChI InChI=1S/C17H15NO2/c19-16-14-10-4-5-11-15(14)18(17(16)20)12-6-9-13-7-2-1-3-8-13/h1-5,7-8,10-11H,6,9,12H2
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.85E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM40314
PNG
(3-(4-Chloro-phenyl)-1,6-dimethyl-1H-pyrimido[5,4-e...)
Show SMILES Cn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccc(Cl)cc1
Show InChI InChI=1S/C13H10ClN5O2/c1-18-12(20)9-11(16-13(18)21)19(2)17-10(15-9)7-3-5-8(14)6-4-7/h3-6H,1-2H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>1.99E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47927
PNG
(2-(3-amino-3-oxopropyl)-3-(4-methylbenzoyl)-6-(tri...)
Show SMILES Cc1ccc(cc1)C(=O)c1n(CCC(N)=O)[n+]([O-])c2cc(ccc12)C(F)(F)F
Show InChI InChI=1S/C19H16F3N3O3/c1-11-2-4-12(5-3-11)18(27)17-14-7-6-13(19(20,21)22)10-15(14)25(28)24(17)9-8-16(23)26/h2-7,10H,8-9H2,1H3,(H2,23,26)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.01E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47894
PNG
(1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)indole-2...)
Show SMILES O=C1N(CC2COc3ccccc3O2)c2ccccc2C1=O
Show InChI InChI=1S/C17H13NO4/c19-16-12-5-1-2-6-13(12)18(17(16)20)9-11-10-21-14-7-3-4-8-15(14)22-11/h1-8,11H,9-10H2
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.08E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47864
PNG
(7-methyl-1-(2-phenoxyethyl)indole-2,3-dione | 7-me...)
Show SMILES Cc1cccc2C(=O)C(=O)N(CCOc3ccccc3)c12
Show InChI InChI=1S/C17H15NO3/c1-12-6-5-9-14-15(12)18(17(20)16(14)19)10-11-21-13-7-3-2-4-8-13/h2-9H,10-11H2,1H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.15E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47897
PNG
(MLS001196771 | N,N-diethyl-2-(3-{(E)-[1-(2-fluorop...)
Show SMILES CCN(CC)C(=O)Cn1cc(C=C2C(=O)NC(=O)N(C2=O)c2ccccc2F)c2ccccc12
Show InChI InChI=1S/C25H23FN4O4/c1-3-28(4-2)22(31)15-29-14-16(17-9-5-7-11-20(17)29)13-18-23(32)27-25(34)30(24(18)33)21-12-8-6-10-19(21)26/h5-14H,3-4,15H2,1-2H3,(H,27,32,34)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.20E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47879
PNG
((E)-3-(2-chlorophenyl)-N-(3-pyridinyl)-2-propenami...)
Show SMILES Clc1ccccc1\C=C\C(=O)Nc1cccnc1
Show InChI InChI=1S/C14H11ClN2O/c15-13-6-2-1-4-11(13)7-8-14(18)17-12-5-3-9-16-10-12/h1-10H,(H,17,18)/b8-7+
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.42E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47888
PNG
(2-Nitro-N-(5-p-tolyl-2H-pyrazol-3-yl)-benzamide | ...)
Show SMILES Cc1ccc(cc1)-c1cc(NC(=O)c2ccccc2[N+]([O-])=O)[nH]n1
Show InChI InChI=1S/C17H14N4O3/c1-11-6-8-12(9-7-11)14-10-16(20-19-14)18-17(22)13-4-2-3-5-15(13)21(23)24/h2-10H,1H3,(H2,18,19,20,22)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 2.43E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47847
PNG
(2-(6-Fluoro-2-methyl-3,4-dihydro-2H-quinolin-1-yl)...)
Show SMILES CC1CCc2cc(F)ccc2N1CC(=O)N1CCc2[nH]c3ccc(C)cc3c2C1
Show InChI InChI=1S/C24H26FN3O/c1-15-3-7-21-19(11-15)20-13-27(10-9-22(20)26-21)24(29)14-28-16(2)4-5-17-12-18(25)6-8-23(17)28/h3,6-8,11-12,16,26H,4-5,9-10,13-14H2,1-2H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.53E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47868
PNG
(1-(m-anisylideneamino)-3-(3-pyridyl)thiourea | 1-[...)
Show SMILES COc1cccc(C=NNC(=S)Nc2cccnc2)c1
Show InChI InChI=1S/C14H14N4OS/c1-19-13-6-2-4-11(8-13)9-16-18-14(20)17-12-5-3-7-15-10-12/h2-10H,1H3,(H2,17,18,20)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.57E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47856
PNG
((E)-3-(4-chloranyl-3-nitro-phenyl)-N-(pyridin-3-yl...)
Show SMILES [O-][N+](=O)c1cc(\C=C\C(=O)NCc2cccnc2)ccc1Cl
Show InChI InChI=1S/C15H12ClN3O3/c16-13-5-3-11(8-14(13)19(21)22)4-6-15(20)18-10-12-2-1-7-17-9-12/h1-9H,10H2,(H,18,20)/b6-4+
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 2.78E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47920
PNG
(MLS001195740 | N-[2-(cyclopentylamino)-2-keto-1-(3...)
Show SMILES CC(C)c1ccc(cc1)N(C(C(=O)NC1CCCC1)c1cccnc1)C(=O)c1csnn1
Show InChI InChI=1S/C24H27N5O2S/c1-16(2)17-9-11-20(12-10-17)29(24(31)21-15-32-28-27-21)22(18-6-5-13-25-14-18)23(30)26-19-7-3-4-8-19/h5-6,9-16,19,22H,3-4,7-8H2,1-2H3,(H,26,30)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.81E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47910
PNG
(2-(3,4-dichlorophenyl)-N-(3-pyridinyl)acetamide | ...)
Show SMILES Clc1ccc(CC(=O)Nc2cccnc2)cc1Cl
Show InChI InChI=1S/C13H10Cl2N2O/c14-11-4-3-9(6-12(11)15)7-13(18)17-10-2-1-5-16-8-10/h1-6,8H,7H2,(H,17,18)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 2.81E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47841
PNG
(2-[2,5-diketo-4-(6-methoxy-2-naphthyl)-4-methyl-im...)
Show SMILES COc1ccc2cc(ccc2c1)C1(C)NC(=O)N(CC(=O)NCc2ccco2)C1=O
Show InChI InChI=1S/C22H21N3O5/c1-22(16-7-5-15-11-17(29-2)8-6-14(15)10-16)20(27)25(21(28)24-22)13-19(26)23-12-18-4-3-9-30-18/h3-11H,12-13H2,1-2H3,(H,23,26)(H,24,28)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 3.11E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47928
PNG
((5E)-1-(2-fluorophenyl)-5-[[1-(2-keto-2-morpholino...)
Show SMILES Fc1ccccc1N1C(=O)NC(=O)C(=Cc2cn(CC(=O)N3CCOCC3)c3ccccc23)C1=O
Show InChI InChI=1S/C25H21FN4O5/c26-19-6-2-4-8-21(19)30-24(33)18(23(32)27-25(30)34)13-16-14-29(20-7-3-1-5-17(16)20)15-22(31)28-9-11-35-12-10-28/h1-8,13-14H,9-12,15H2,(H,27,32,34)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 3.43E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47898
PNG
((3-bromanyl-4-methyl-phenyl)-(3,5-dimethylpyrazol-...)
Show SMILES Cc1cc(C)n(n1)C(=O)c1ccc(C)c(Br)c1
Show InChI InChI=1S/C13H13BrN2O/c1-8-4-5-11(7-12(8)14)13(17)16-10(3)6-9(2)15-16/h4-7H,1-3H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 3.49E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47878
PNG
((E)-3-(2-chloranyl-6-fluoranyl-phenyl)-N-pyridin-3...)
Show SMILES Fc1cccc(Cl)c1\C=C\C(=O)Nc1cccnc1
Show InChI InChI=1S/C14H10ClFN2O/c15-12-4-1-5-13(16)11(12)6-7-14(19)18-10-3-2-8-17-9-10/h1-9H,(H,18,19)/b7-6+
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 3.68E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47839
PNG
(2-(1-benzotriazolyl)-N-(2,6-diethylphenyl)-N-(meth...)
Show SMILES CCc1cccc(CC)c1N(COC)C(=O)Cn1nnc2ccccc12
Show InChI InChI=1S/C20H24N4O2/c1-4-15-9-8-10-16(5-2)20(15)23(14-26-3)19(25)13-24-18-12-7-6-11-17(18)21-22-24/h6-12H,4-5,13-14H2,1-3H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 4.05E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM32798
PNG
((2-acetyl-1-methylindol-3-yl) furan-2-carboxylate ...)
Show SMILES CC(=O)c1c(OC(=O)c2ccco2)c2ccccc2n1C
Show InChI InChI=1S/C16H13NO4/c1-10(18)14-15(21-16(19)13-8-5-9-20-13)11-6-3-4-7-12(11)17(14)2/h3-9H,1-2H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 4.53E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47915
PNG
((5S,5aR,8aS,8bR)-2-(3-bromophenyl)-5-(4-chlorophen...)
Show SMILES C[C@]12[C@@H]3[C@H]([C@H](N1C(=O)N(C2=O)c1cccc(Br)c1)c1ccc(Cl)cc1)C(=O)N(C1CCCCC1)C3=O
Show InChI InChI=1S/C27H25BrClN3O4/c1-27-21-20(23(33)30(24(21)34)18-7-3-2-4-8-18)22(15-10-12-17(29)13-11-15)32(27)26(36)31(25(27)35)19-9-5-6-16(28)14-19/h5-6,9-14,18,20-22H,2-4,7-8H2,1H3/t20-,21-,22-,27-/m1/s1
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.96E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47882
PNG
(MLS001008053 | N-(2-keto-4-methyl-chromen-7-yl)-2-...)
Show SMILES Cc1cc(=O)oc2cc(NC(=O)Cc3ccccc3[N+]([O-])=O)ccc12
Show InChI InChI=1S/C18H14N2O5/c1-11-8-18(22)25-16-10-13(6-7-14(11)16)19-17(21)9-12-4-2-3-5-15(12)20(23)24/h2-8,10H,9H2,1H3,(H,19,21)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>5.96E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47917
PNG
(2-amino-N-[3,5-bis(trifluoromethyl)phenyl]-5-bromo...)
Show SMILES Nc1ncc(Br)cc1S(=O)(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C13H8BrF6N3O2S/c14-8-4-10(11(21)22-5-8)26(24,25)23-9-2-6(12(15,16)17)1-7(3-9)13(18,19)20/h1-5,23H,(H2,21,22)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>5.96E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47912
PNG
((2S)-2-[[5-[[4-[(tert-butoxycarbonylamino)methyl]b...)
Show SMILES CC(C)C[C@H](NC(=O)c1nc[nH]c1C(=O)NCc1ccc(CNC(=O)OC(C)(C)C)cc1)C(=O)OC(C)(C)C
Show InChI InChI=1S/C28H41N5O6/c1-17(2)13-20(25(36)38-27(3,4)5)33-24(35)22-21(31-16-32-22)23(34)29-14-18-9-11-19(12-10-18)15-30-26(37)39-28(6,7)8/h9-12,16-17,20H,13-15H2,1-8H3,(H,29,34)(H,30,37)(H,31,32)(H,33,35)/t20-/m0/s1
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.96E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47914
PNG
(4-methyl-3-[[4-(phenoxymethyl)benzoyl]carbamothioy...)
Show SMILES Cc1ccc(cc1NC(=S)NC(=O)c1ccc(COc2ccccc2)cc1)C(O)=O
Show InChI InChI=1S/C23H20N2O4S/c1-15-7-10-18(22(27)28)13-20(15)24-23(30)25-21(26)17-11-8-16(9-12-17)14-29-19-5-3-2-4-6-19/h2-13H,14H2,1H3,(H,27,28)(H2,24,25,26,30)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.96E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47840
PNG
(2-[2-chloro-4-(trifluoromethyl)anilino]-3-methyl-b...)
Show SMILES CC(C)C(Nc1ccc(cc1Cl)C(F)(F)F)C(=O)OCC(=O)Nc1cc(C)on1
Show InChI InChI=1S/C18H19ClF3N3O4/c1-9(2)16(23-13-5-4-11(7-12(13)19)18(20,21)22)17(27)28-8-15(26)24-14-6-10(3)29-25-14/h4-7,9,16,23H,8H2,1-3H3,(H,24,25,26)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a>5.96E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47904
PNG
(2-cyano-N-[(1,2-diphenyl-3-indolyl)methylideneamin...)
Show SMILES O=C(CC#N)NN=Cc1c(-c2ccccc2)n(-c2ccccc2)c2ccccc12
Show InChI InChI=1S/C24H18N4O/c25-16-15-23(29)27-26-17-21-20-13-7-8-14-22(20)28(19-11-5-2-6-12-19)24(21)18-9-3-1-4-10-18/h1-14,17H,15H2,(H,27,29)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a>5.96E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47884
PNG
(3,3'-[(5-bromo-2-hydroxyphenyl)methylene]bis(1...)
Show SMILES OC(=O)c1[nH]c2ccccc2c1C(c1c([nH]c2ccccc12)C(O)=O)c1cc(Br)ccc1O
Show InChI InChI=1S/C25H17BrN2O5/c26-12-9-10-18(29)15(11-12)19(20-13-5-1-3-7-16(13)27-22(20)24(30)31)21-14-6-2-4-8-17(14)28-23(21)25(32)33/h1-11,19,27-29H,(H,30,31)(H,32,33)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.96E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47846
PNG
(3-pyridinyl 4-methoxybenzoate | 4-methoxybenzoic a...)
Show SMILES COc1ccc(cc1)C(=O)Oc1cccnc1
Show InChI InChI=1S/C13H11NO3/c1-16-11-6-4-10(5-7-11)13(15)17-12-3-2-8-14-9-12/h2-9H,1H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.96E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47854
PNG
(2-hydroxy-N-[4-(2,2,3,3-tetrafluoropropoxy)-3-(tri...)
Show SMILES Oc1ccccc1C(=O)Nc1ccc(OCC(F)(F)C(F)F)c(c1)C(F)(F)F
Show InChI InChI=1S/C17H12F7NO3/c18-15(19)16(20,21)8-28-13-6-5-9(7-11(13)17(22,23)24)25-14(27)10-3-1-2-4-12(10)26/h1-7,15,26H,8H2,(H,25,27)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.96E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47867
PNG
(1-[(6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)methy...)
Show SMILES CC1(C)C2CC1C(C=NNC(=S)Nc1cccnc1)=CC2
Show InChI InChI=1S/C16H20N4S/c1-16(2)12-6-5-11(14(16)8-12)9-18-20-15(21)19-13-4-3-7-17-10-13/h3-5,7,9-10,12,14H,6,8H2,1-2H3,(H2,19,20,21)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.96E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47896
PNG
(4-butoxybenzoic acid 3-pyridinyl ester | 4-butoxyb...)
Show SMILES CCCCOc1ccc(cc1)C(=O)Oc1cccnc1
Show InChI InChI=1S/C16H17NO3/c1-2-3-11-19-14-8-6-13(7-9-14)16(18)20-15-5-4-10-17-12-15/h4-10,12H,2-3,11H2,1H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.96E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47885
PNG
(3,3'-{[5-bromo-2-(carboxymethoxy)phenyl]methyl...)
Show SMILES OC(=O)COc1ccc(Br)cc1C(c1c([nH]c2ccccc12)C(O)=O)c1c([nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C27H19BrN2O7/c28-13-9-10-19(37-12-20(31)32)16(11-13)21(22-14-5-1-3-7-17(14)29-24(22)26(33)34)23-15-6-2-4-8-18(15)30-25(23)27(35)36/h1-11,21,29-30H,12H2,(H,31,32)(H,33,34)(H,35,36)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.96E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM31040
PNG
(1-Ethyl-6-methyl-3-phenyl-1H-pyrimido[5,4-e][1,2,4...)
Show SMILES CCn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccccc1
Show InChI InChI=1S/C14H13N5O2/c1-3-19-12-10(13(20)18(2)14(21)16-12)15-11(17-19)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

PCBioAssay
n/an/a>5.96E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
3C-like protease


(Avian infectious bronchitis virus)
BDBM47881
PNG
(4-(2-phthalimidoacetyl)oxybenzoic acid methyl este...)
Show SMILES COC(=O)c1ccc(OC(=O)CN2C(=O)c3ccccc3C2=O)cc1
Show InChI InChI=1S/C18H13NO6/c1-24-18(23)11-6-8-12(9-7-11)25-15(20)10-19-16(21)13-4-2-3-5-14(13)17(19)22/h2-9H,10H2,1H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.96E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29K48NM
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%