BindingDB logo
myBDB logout

28 similar compounds to monomer 50031907

Compile data set for download or QSAR
Wt: 332.3
BDBM40014
Purchase
Wt: 322.4
BDBM48462
Purchase
Wt: 278.3
BDBM50574
Purchase
Wt: 348.4
BDBM54766
Purchase
Wt: 358.3
BDBM65776
Purchase
Wt: 358.3
BDBM65777
Purchase
Wt: 415.4
BDBM65781
Wt: 372.4
BDBM65783
Purchase
Wt: 342.3
BDBM65786
Wt: 372.4
BDBM65787
Wt: 376.8
BDBM65789
Purchase
Wt: 343.3
BDBM65790
Purchase
Wt: 343.3
BDBM65791
Purchase
Wt: 343.3
BDBM65792
Wt: 356.4
BDBM65793
Displayed 1 to 15 (of 28 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 38 hits for monomerid = 40014,48462,50574,54766,65776,65777,65781,65783,65786,65787,65789,65790,65791,65792,65793   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Estrogen receptor


(Homo sapiens (Human))
BDBM40014
PNG
(MLS000043380 | N-(2-furanylmethyl)-2-(5-methyl-2-f...)
Show SMILES Cc1ccc(o1)-c1cc(C(=O)NCc2ccco2)c2ccccc2n1
Show InChI InChI=1S/C20H16N2O3/c1-13-8-9-19(25-13)18-11-16(15-6-2-3-7-17(15)22-18)20(23)21-12-14-5-4-10-24-14/h2-11H,12H2,1H3,(H,21,23)
PDB

UniProtKB/SwissProt

GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 6.84E+3n/an/an/an/an/an/a



Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2QJ7FQ3
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65783
PNG
(2-(2-furanyl)-N-[2-(4-methoxyphenyl)ethyl]-4-quino...)
Show SMILES COc1ccc(CCNC(=O)c2cc(nc3ccccc23)-c2ccco2)cc1
Show InChI InChI=1S/C23H20N2O3/c1-27-17-10-8-16(9-11-17)12-13-24-23(26)19-15-21(22-7-4-14-28-22)25-20-6-3-2-5-18(19)20/h2-11,14-15H,12-13H2,1H3,(H,24,26)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 4.08E+3n/an/an/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC_KCNQ2_Inh_HFCP_IWS_CRC) Center Affiliation: Johns Hopkins University, School of M...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2W37TT2
More data for this
Ligand-Target Pair
Estradiol receptor beta (ERβ)


(Homo sapiens (Human))
BDBM40014
PNG
(MLS000043380 | N-(2-furanylmethyl)-2-(5-methyl-2-f...)
Show SMILES Cc1ccc(o1)-c1cc(C(=O)NCc2ccco2)c2ccccc2n1
Show InChI InChI=1S/C20H16N2O3/c1-13-8-9-19(25-13)18-11-16(15-6-2-3-7-17(15)22-18)20(23)21-12-14-5-4-10-24-14/h2-11H,12H2,1H3,(H,21,23)
PDB

UniProtKB/SwissProt

GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 3.37E+3n/an/an/an/an/an/a



Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2WD3Z0J
More data for this
Ligand-Target Pair
Estradiol receptor beta (ERβ)


(Homo sapiens (Human))
BDBM48462
PNG
(2-(2-furanyl)-N-hexyl-4-quinolinecarboxamide | 2-(...)
Show SMILES CCCCCCNC(=O)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C20H22N2O2/c1-2-3-4-7-12-21-20(23)16-14-18(19-11-8-13-24-19)22-17-10-6-5-9-15(16)17/h5-6,8-11,13-14H,2-4,7,12H2,1H3,(H,21,23)
PDB

UniProtKB/SwissProt

GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.60E+3n/an/an/an/an/an/a



Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2WD3Z0J
More data for this
Ligand-Target Pair
BZLF2


(Human herpesvirus 4 type 2)
BDBM50574
PNG
(MLS001005620 | N-cyclopropyl-2-(2-furanyl)-4-quino...)
Show SMILES O=C(NC1CC1)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C17H14N2O2/c20-17(18-11-7-8-11)13-10-15(16-6-3-9-21-16)19-14-5-2-1-4-12(13)14/h1-6,9-11H,7-8H2,(H,18,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 3.67E+3n/an/an/an/an/an/a



Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Theodore Jardetzky; Northw...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2057DCW
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM50574
PNG
(MLS001005620 | N-cyclopropyl-2-(2-furanyl)-4-quino...)
Show SMILES O=C(NC1CC1)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C17H14N2O2/c20-17(18-11-7-8-11)13-10-15(16-6-3-9-21-16)19-14-5-2-1-4-12(13)14/h1-6,9-11H,7-8H2,(H,18,20)
PDB
MMDB

NCI pathway
KEGG

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.71E+3n/an/an/an/an/an/a



Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Nikolovska-Coleska, Univer...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q23X8539
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM54766
PNG
((3,5-dimethyl-1-piperidinyl)-[2-(5-methyl-2-furany...)
Show SMILES CC1CC(C)CN(C1)C(=O)c1cc(nc2ccccc12)-c1ccc(C)o1
Show InChI InChI=1S/C22H24N2O2/c1-14-10-15(2)13-24(12-14)22(25)18-11-20(21-9-8-16(3)26-21)23-19-7-5-4-6-17(18)19/h4-9,11,14-15H,10,12-13H2,1-3H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 5.42E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q20P0XFH
More data for this
Ligand-Target Pair
Voltage-gated calcium channel subunit alpha Cav2.2


(Homo sapiens (Human))
BDBM54766
PNG
((3,5-dimethyl-1-piperidinyl)-[2-(5-methyl-2-furany...)
Show SMILES CC1CC(C)CN(C1)C(=O)c1cc(nc2ccccc12)-c1ccc(C)o1
Show InChI InChI=1S/C22H24N2O2/c1-14-10-15(2)13-24(12-14)22(25)18-11-20(21-9-8-16(3)26-21)23-19-7-5-4-6-17(18)19/h4-9,11,14-15H,10,12-13H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.13E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute Network...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2PZ578V
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65776
PNG
(2-(2-furanyl)-N-[(2-methoxyphenyl)methyl]-4-quinol...)
Show SMILES COc1ccccc1CNC(=O)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C22H18N2O3/c1-26-20-10-5-2-7-15(20)14-23-22(25)17-13-19(21-11-6-12-27-21)24-18-9-4-3-8-16(17)18/h2-13H,14H2,1H3,(H,23,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.47E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21V5CDC
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65777
PNG
(2-(2-furanyl)-N-[(4-methoxyphenyl)methyl]-4-quinol...)
Show SMILES COc1ccc(CNC(=O)c2cc(nc3ccccc23)-c2ccco2)cc1
Show InChI InChI=1S/C22H18N2O3/c1-26-16-10-8-15(9-11-16)14-23-22(25)18-13-20(21-7-4-12-27-21)24-19-6-3-2-5-17(18)19/h2-13H,14H2,1H3,(H,23,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.68E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21V5CDC
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65781
PNG
(2-(2-furanyl)-N-[2-[(2-methoxyphenyl)methylamino]-...)
Show SMILES COc1ccccc1CNC(=O)CNC(=O)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C24H21N3O4/c1-30-21-10-5-2-7-16(21)14-25-23(28)15-26-24(29)18-13-20(22-11-6-12-31-22)27-19-9-4-3-8-17(18)19/h2-13H,14-15H2,1H3,(H,25,28)(H,26,29)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.33E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21V5CDC
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65783
PNG
(2-(2-furanyl)-N-[2-(4-methoxyphenyl)ethyl]-4-quino...)
Show SMILES COc1ccc(CCNC(=O)c2cc(nc3ccccc23)-c2ccco2)cc1
Show InChI InChI=1S/C23H20N2O3/c1-27-17-10-8-16(9-11-17)12-13-24-23(26)19-15-21(22-7-4-14-28-22)25-20-6-3-2-5-18(19)20/h2-11,14-15H,12-13H2,1H3,(H,24,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.73E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21V5CDC
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65786
PNG
(2-(2-furanyl)-N-(2-phenylethyl)-4-quinolinecarboxa...)
Show SMILES O=C(NCCc1ccccc1)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C22H18N2O2/c25-22(23-13-12-16-7-2-1-3-8-16)18-15-20(21-11-6-14-26-21)24-19-10-5-4-9-17(18)19/h1-11,14-15H,12-13H2,(H,23,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.68E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21V5CDC
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65787
PNG
(2-(2-furanyl)-N-[2-(3-methoxyphenyl)ethyl]-4-quino...)
Show SMILES COc1cccc(CCNC(=O)c2cc(nc3ccccc23)-c2ccco2)c1
Show InChI InChI=1S/C23H20N2O3/c1-27-17-7-4-6-16(14-17)11-12-24-23(26)19-15-21(22-10-5-13-28-22)25-20-9-3-2-8-18(19)20/h2-10,13-15H,11-12H2,1H3,(H,24,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.68E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21V5CDC
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65789
PNG
(N-[2-(3-chlorophenyl)ethyl]-2-(2-furanyl)-4-quinol...)
Show SMILES Clc1cccc(CCNC(=O)c2cc(nc3ccccc23)-c2ccco2)c1
Show InChI InChI=1S/C22H17ClN2O2/c23-16-6-3-5-15(13-16)10-11-24-22(26)18-14-20(21-9-4-12-27-21)25-19-8-2-1-7-17(18)19/h1-9,12-14H,10-11H2,(H,24,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.68E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21V5CDC
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65790
PNG
(2-(2-furanyl)-N-[2-(2-pyridinyl)ethyl]-4-quinoline...)
Show SMILES O=C(NCCc1ccccn1)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C21H17N3O2/c25-21(23-12-10-15-6-3-4-11-22-15)17-14-19(20-9-5-13-26-20)24-18-8-2-1-7-16(17)18/h1-9,11,13-14H,10,12H2,(H,23,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.68E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21V5CDC
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65791
PNG
(2-(2-furanyl)-N-[2-(3-pyridinyl)ethyl]-4-quinoline...)
Show SMILES O=C(NCCc1cccnc1)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C21H17N3O2/c25-21(23-11-9-15-5-3-10-22-14-15)17-13-19(20-8-4-12-26-20)24-18-7-2-1-6-16(17)18/h1-8,10,12-14H,9,11H2,(H,23,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.92E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21V5CDC
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65792
PNG
(2-(2-furanyl)-N-(2-pyridin-4-ylethyl)-4-quinolinec...)
Show SMILES O=C(NCCc1ccncc1)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C21H17N3O2/c25-21(23-12-9-15-7-10-22-11-8-15)17-14-19(20-6-3-13-26-20)24-18-5-2-1-4-16(17)18/h1-8,10-11,13-14H,9,12H2,(H,23,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.68E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21V5CDC
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65793
PNG
(2-(2-furanyl)-N-(3-phenylpropyl)-4-quinolinecarbox...)
Show SMILES O=C(NCCCc1ccccc1)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C23H20N2O2/c26-23(24-14-6-10-17-8-2-1-3-9-17)19-16-21(22-13-7-15-27-22)25-20-12-5-4-11-18(19)20/h1-5,7-9,11-13,15-16H,6,10,14H2,(H,24,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.68E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21V5CDC
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65783
PNG
(2-(2-furanyl)-N-[2-(4-methoxyphenyl)ethyl]-4-quino...)
Show SMILES COc1ccc(CCNC(=O)c2cc(nc3ccccc23)-c2ccco2)cc1
Show InChI InChI=1S/C23H20N2O3/c1-27-17-10-8-16(9-11-17)12-13-24-23(26)19-15-21(22-7-4-14-28-22)25-20-6-3-2-5-18(19)20/h2-11,14-15H,12-13H2,1H3,(H,24,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.68E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21V5CDC
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65776
PNG
(2-(2-furanyl)-N-[(2-methoxyphenyl)methyl]-4-quinol...)
Show SMILES COc1ccccc1CNC(=O)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C22H18N2O3/c1-26-20-10-5-2-7-15(20)14-23-22(25)17-13-19(21-11-6-12-27-21)24-18-9-4-3-8-16(17)18/h2-13H,14H2,1H3,(H,23,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

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



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2668BMS
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65777
PNG
(2-(2-furanyl)-N-[(4-methoxyphenyl)methyl]-4-quinol...)
Show SMILES COc1ccc(CNC(=O)c2cc(nc3ccccc23)-c2ccco2)cc1
Show InChI InChI=1S/C22H18N2O3/c1-26-16-10-8-15(9-11-16)14-23-22(25)18-13-20(21-7-4-12-27-21)24-19-6-3-2-5-17(18)19/h2-13H,14H2,1H3,(H,23,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.03E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2668BMS
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65781
PNG
(2-(2-furanyl)-N-[2-[(2-methoxyphenyl)methylamino]-...)
Show SMILES COc1ccccc1CNC(=O)CNC(=O)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C24H21N3O4/c1-30-21-10-5-2-7-16(21)14-25-23(28)15-26-24(29)18-13-20(22-11-6-12-31-22)27-19-9-4-3-8-17(18)19/h2-13H,14-15H2,1H3,(H,25,28)(H,26,29)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.68E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2668BMS
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65783
PNG
(2-(2-furanyl)-N-[2-(4-methoxyphenyl)ethyl]-4-quino...)
Show SMILES COc1ccc(CCNC(=O)c2cc(nc3ccccc23)-c2ccco2)cc1
Show InChI InChI=1S/C23H20N2O3/c1-27-17-10-8-16(9-11-17)12-13-24-23(26)19-15-21(22-7-4-14-28-22)25-20-6-3-2-5-18(19)20/h2-11,14-15H,12-13H2,1H3,(H,24,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.28E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2668BMS
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65786
PNG
(2-(2-furanyl)-N-(2-phenylethyl)-4-quinolinecarboxa...)
Show SMILES O=C(NCCc1ccccc1)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C22H18N2O2/c25-22(23-13-12-16-7-2-1-3-8-16)18-15-20(21-11-6-14-26-21)24-19-10-5-4-9-17(18)19/h1-11,14-15H,12-13H2,(H,23,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.68E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2668BMS
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65787
PNG
(2-(2-furanyl)-N-[2-(3-methoxyphenyl)ethyl]-4-quino...)
Show SMILES COc1cccc(CCNC(=O)c2cc(nc3ccccc23)-c2ccco2)c1
Show InChI InChI=1S/C23H20N2O3/c1-27-17-7-4-6-16(14-17)11-12-24-23(26)19-15-21(22-10-5-13-28-22)25-20-9-3-2-8-18(19)20/h2-10,13-15H,11-12H2,1H3,(H,24,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.68E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2668BMS
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65789
PNG
(N-[2-(3-chlorophenyl)ethyl]-2-(2-furanyl)-4-quinol...)
Show SMILES Clc1cccc(CCNC(=O)c2cc(nc3ccccc23)-c2ccco2)c1
Show InChI InChI=1S/C22H17ClN2O2/c23-16-6-3-5-15(13-16)10-11-24-22(26)18-14-20(21-9-4-12-27-21)25-19-8-2-1-7-17(18)19/h1-9,12-14H,10-11H2,(H,24,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.68E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2668BMS
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65790
PNG
(2-(2-furanyl)-N-[2-(2-pyridinyl)ethyl]-4-quinoline...)
Show SMILES O=C(NCCc1ccccn1)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C21H17N3O2/c25-21(23-12-10-15-6-3-4-11-22-15)17-14-19(20-9-5-13-26-20)24-18-8-2-1-7-16(17)18/h1-9,11,13-14H,10,12H2,(H,23,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.68E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2668BMS
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65791
PNG
(2-(2-furanyl)-N-[2-(3-pyridinyl)ethyl]-4-quinoline...)
Show SMILES O=C(NCCc1cccnc1)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C21H17N3O2/c25-21(23-11-9-15-5-3-10-22-14-15)17-13-19(20-8-4-12-26-20)24-18-7-2-1-6-16(17)18/h1-8,10,12-14H,9,11H2,(H,23,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.68E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2668BMS
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65792
PNG
(2-(2-furanyl)-N-(2-pyridin-4-ylethyl)-4-quinolinec...)
Show SMILES O=C(NCCc1ccncc1)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C21H17N3O2/c25-21(23-12-9-15-7-10-22-11-8-15)17-14-19(20-6-3-13-26-20)24-18-5-2-1-4-16(17)18/h1-8,10-11,13-14H,9,12H2,(H,23,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.68E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2668BMS
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65793
PNG
(2-(2-furanyl)-N-(3-phenylpropyl)-4-quinolinecarbox...)
Show SMILES O=C(NCCCc1ccccc1)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C23H20N2O2/c26-23(24-14-6-10-17-8-2-1-3-9-17)19-16-21(22-13-7-15-27-22)25-20-12-5-4-11-18(19)20/h1-5,7-9,11-13,15-16H,6,10,14H2,(H,24,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 4.47E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2668BMS
More data for this
Ligand-Target Pair
neuronal munc18-1 binding protein


(Rattus norvegicus)
BDBM65783
PNG
(2-(2-furanyl)-N-[2-(4-methoxyphenyl)ethyl]-4-quino...)
Show SMILES COc1ccc(CCNC(=O)c2cc(nc3ccccc23)-c2ccco2)cc1
Show InChI InChI=1S/C23H20N2O3/c1-27-17-10-8-16(9-11-17)12-13-24-23(26)19-15-21(22-7-4-14-28-22)25-20-6-3-2-5-18(19)20/h2-11,14-15H,12-13H2,1H3,(H,24,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.68E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2668BMS
More data for this
Ligand-Target Pair
probable DNA dC->dU-editing enzyme APOBEC-3A


(Homo sapiens (Human))
BDBM48462
PNG
(2-(2-furanyl)-N-hexyl-4-quinolinecarboxamide | 2-(...)
Show SMILES CCCCCCNC(=O)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C20H22N2O2/c1-2-3-4-7-12-21-20(23)16-14-18(19-11-8-13-24-19)22-17-10-6-5-9-15(16)17/h5-6,8-11,13-14H,2-4,7,12H2,1H3,(H,21,23)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.36E+4n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q24F1P6P
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM48462
PNG
(2-(2-furanyl)-N-hexyl-4-quinolinecarboxamide | 2-(...)
Show SMILES CCCCCCNC(=O)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C20H22N2O2/c1-2-3-4-7-12-21-20(23)16-14-18(19-11-8-13-24-19)22-17-10-6-5-9-15(16)17/h5-6,8-11,13-14H,2-4,7,12H2,1H3,(H,21,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.60E+4n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2862DX0
More data for this
Ligand-Target Pair
carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1 isoform 1


(Homo sapiens (Human))
BDBM48462
PNG
(2-(2-furanyl)-N-hexyl-4-quinolinecarboxamide | 2-(...)
Show SMILES CCCCCCNC(=O)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C20H22N2O2/c1-2-3-4-7-12-21-20(23)16-14-18(19-11-8-13-24-19)22-17-10-6-5-9-15(16)17/h5-6,8-11,13-14H,2-4,7,12H2,1H3,(H,21,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

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



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2V986KM
More data for this
Ligand-Target Pair
carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1 isoform 1


(Homo sapiens (Human))
BDBM65783
PNG
(2-(2-furanyl)-N-[2-(4-methoxyphenyl)ethyl]-4-quino...)
Show SMILES COc1ccc(CCNC(=O)c2cc(nc3ccccc23)-c2ccco2)cc1
Show InChI InChI=1S/C23H20N2O3/c1-27-17-10-8-16(9-11-17)12-13-24-23(26)19-15-21(22-7-4-14-28-22)25-20-6-3-2-5-18(19)20/h2-11,14-15H,12-13H2,1H3,(H,24,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 4.22E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2V986KM
More data for this
Ligand-Target Pair
carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1 isoform 1


(Homo sapiens (Human))
BDBM40014
PNG
(MLS000043380 | N-(2-furanylmethyl)-2-(5-methyl-2-f...)
Show SMILES Cc1ccc(o1)-c1cc(C(=O)NCc2ccco2)c2ccccc2n1
Show InChI InChI=1S/C20H16N2O3/c1-13-8-9-19(25-13)18-11-16(15-6-2-3-7-17(15)22-18)20(23)21-12-14-5-4-10-24-14/h2-11H,12H2,1H3,(H,21,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 4.39E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2V986KM
More data for this
Ligand-Target Pair
Estradiol receptor beta (ERβ)


(Homo sapiens (Human))
BDBM40014
PNG
(MLS000043380 | N-(2-furanylmethyl)-2-(5-methyl-2-f...)
Show SMILES Cc1ccc(o1)-c1cc(C(=O)NCc2ccco2)c2ccccc2n1
Show InChI InChI=1S/C20H16N2O3/c1-13-8-9-19(25-13)18-11-16(15-6-2-3-7-17(15)22-18)20(23)21-12-14-5-4-10-24-14/h2-11H,12H2,1H3,(H,21,23)
PDB

UniProtKB/SwissProt

GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 5.00E+4n/an/an/an/an/an/a



Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2CF9NHH
More data for this
Ligand-Target Pair