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BDBM50318196 (Z)-2-(4-((7-(2-Methoxyphenyl)-9-oxo-5H-benzo[h]thiazolo[2,3-b]-quinazolin-10(6H,7H,9H)-ylidene)methyl)phenoxy)acetic Acid::CHEMBL1094809

SMILES: COc1ccccc1C1C2=C(N=c3s\c(=C/c4ccc(OCC(O)=O)cc4)c(=O)n13)c1ccccc1CC2

InChI Key: InChIKey=WIONWZSKKIITNQ-XYGWBWBKNA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50318196   
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))
BDBM50318196
PNG
((Z)-2-(4-((7-(2-Methoxyphenyl)-9-oxo-5H-benzo[h]th...)
Show SMILES COc1ccccc1C1C2=C(N=c3s\c(=C/c4ccc(OCC(O)=O)cc4)c(=O)n13)c1ccccc1CC2
Show InChI InChI=1/C30H24N2O5S/c1-36-24-9-5-4-8-22(24)28-23-15-12-19-6-2-3-7-21(19)27(23)31-30-32(28)29(35)25(38-30)16-18-10-13-20(14-11-18)37-17-26(33)34/h2-11,13-14,16,28H,12,15,17H2,1H3,(H,33,34)/b25-16-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.60E+4n/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