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BDBM50318213 (Z)-3-(5-((7-(3-Nitrophenyl)-9-oxo-5H-benzo[h]thiazolo[2,3-b]-quinazolin-10(6H,7H,9H)-ylidene)methyl)furan-2-yl)benzoic Acid::CHEMBL1095307

SMILES: OC(=O)c1cccc(c1)-c1ccc(\C=c2/sc3=NC4=C(CCc5ccccc45)C(c4cccc(c4)[N+]([O-])=O)n3c2=O)o1

InChI Key: InChIKey=LICNTIFELLNVBY-PKAZHMFMSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50318213   
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
Bcl-2-like protein 1


(Homo sapiens (Human))
BDBM50318213
PNG
((Z)-3-(5-((7-(3-Nitrophenyl)-9-oxo-5H-benzo[h]thia...)
Show SMILES OC(=O)c1cccc(c1)-c1ccc(\C=c2/sc3=NC4=C(CCc5ccccc45)C(c4cccc(c4)[N+]([O-])=O)n3c2=O)o1 |t:17,19|
Show InChI InChI=1S/C32H21N3O6S/c36-30-27(17-23-12-14-26(41-23)19-6-3-8-21(15-19)31(37)38)42-32-33-28-24-10-2-1-5-18(24)11-13-25(28)29(34(30)32)20-7-4-9-22(16-20)35(39)40/h1-10,12,14-17,29H,11,13H2,(H,37,38)/b27-17-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.90E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human Bcl-XL


J Med Chem 53: 3465-79 (2010)


Article DOI: 10.1021/jm901004c
BindingDB Entry DOI: 10.7270/Q2QF8T11
More data for this
Ligand-Target Pair