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5 similar compounds to monomer 29616

Compile data set for download or QSAR
Wt: 383.4
BDBM120841
Wt: 408.2
BDBM120842
Wt: 368.3
BDBM120843
Wt: 349.4
BDBM50343400
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Wt: 293.3
BDBM50383084
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 120841,120842,120843,50343400,50383084   
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
Xanthine dehydrogenase


(Bos taurus (Bovine))
BDBM120841
PNG
(5‐(3,4‐dimethoxyphenyl)‐2‐...)
Show SMILES COc1ccc(cc1OC)C1Nc2ccccc2-c2cc(nn12)-c1ccccc1
Show InChI InChI=1S/C24H21N3O2/c1-28-22-13-12-17(14-23(22)29-2)24-25-19-11-7-6-10-18(19)21-15-20(26-27(21)24)16-8-4-3-5-9-16/h3-15,24-25H,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.37E+4n/an/an/an/a7.525



Central University of Punjab



Assay Description
The reaction mixture contained 1.5 mL of 50 mM potassium phosphate buffer (pH 7.5), 1 mL test sample solutions (5, 10, 25, 50, and 100 µM) was d...


Bioorg Chem 57: 57-64 (2014)


Article DOI: 10.1016/j.bioorg.2014.08.007
BindingDB Entry DOI: 10.7270/Q22Z146M
More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Bos taurus (Bovine))
BDBM120842
PNG
(2,4‐dichloro‐6‐{2‐phenyl&#...)
Show SMILES Oc1c(Cl)cc(Cl)cc1C1Nc2ccccc2-c2cc(nn12)-c1ccccc1
Show InChI InChI=1S/C22H15Cl2N3O/c23-14-10-16(21(28)17(24)11-14)22-25-18-9-5-4-8-15(18)20-12-19(26-27(20)22)13-6-2-1-3-7-13/h1-12,22,25,28H
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.10E+4n/an/an/an/a7.525



Central University of Punjab



Assay Description
The reaction mixture contained 1.5 mL of 50 mM potassium phosphate buffer (pH 7.5), 1 mL test sample solutions (5, 10, 25, 50, and 100 µM) was d...


Bioorg Chem 57: 57-64 (2014)


Article DOI: 10.1016/j.bioorg.2014.08.007
BindingDB Entry DOI: 10.7270/Q22Z146M
More data for this
Ligand-Target Pair
Kinesin-like protein 1


(Homo sapiens)
BDBM50383084
PNG
(CHEMBL2031568)
Show SMILES Cc1cc2-c3cc(C)ccc3NC(c3ccccc3F)n2n1
Show InChI InChI=1S/C18H16FN3/c1-11-7-8-16-14(9-11)17-10-12(2)21-22(17)18(20-16)13-5-3-4-6-15(13)19/h3-10,18,20H,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.30E+3n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of Eg5 ATPase activity by pyruvate kinase/lactate dehydrogenase-linked assay


J Med Chem 55: 2561-73 (2012)


Article DOI: 10.1021/jm201290v
BindingDB Entry DOI: 10.7270/Q2M909P0
More data for this
Ligand-Target Pair
Uracil-DNA glycosylase


(Vaccinia virus (strain Western Reserve) (VACV) (Va...)
BDBM50343400
PNG
((4-tert-butyl-6-{2-methyl-5H,6H-pyrazolo[1,5-c]qui...)
Show SMILES Cc1cc2-c3ccccc3NC(c3cc(c(O)cc3O)C(C)(C)C)n2n1
Show InChI InChI=1S/C21H23N3O2/c1-12-9-17-13-7-5-6-8-16(13)22-20(24(17)23-12)14-10-15(21(2,3)4)19(26)11-18(14)25/h5-11,20,22,25-26H,1-4H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 1.38E+5n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Inhibition of Vaccinia virus WR strain processivity factor D4 interaction with A20 protein assessed as inhibition of E9 DNA polymerase-mediated DIG-d...


J Med Chem 54: 3260-7 (2011)


Article DOI: 10.1021/jm101554k
BindingDB Entry DOI: 10.7270/Q2J103GF
More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Bos taurus (Bovine))
BDBM120843
PNG
(5‐(3‐nitrophenyl)‐2‐phenyl...)
Show SMILES [O-][N+](=O)c1cccc(c1)C1Nc2ccccc2-c2cc(nn12)-c1ccccc1
Show InChI InChI=1S/C22H16N4O2/c27-26(28)17-10-6-9-16(13-17)22-23-19-12-5-4-11-18(19)21-14-20(24-25(21)22)15-7-2-1-3-8-15/h1-14,22-23H
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.09E+4n/an/an/an/a7.525



Central University of Punjab



Assay Description
The reaction mixture contained 1.5 mL of 50 mM potassium phosphate buffer (pH 7.5), 1 mL test sample solutions (5, 10, 25, 50, and 100 µM) was d...


Bioorg Chem 57: 57-64 (2014)


Article DOI: 10.1016/j.bioorg.2014.08.007
BindingDB Entry DOI: 10.7270/Q22Z146M
More data for this
Ligand-Target Pair