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BDBM50436631 CHEMBL2398280

SMILES: CC(N=Nc1ccc2ccccc2n1)c1ccc(o1)-c1cccc(C(O)=O)c1Cl

InChI Key: InChIKey=APPXRKOCTBCFNE-UHFFFAOYSA-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 = 50436631   
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))
BDBM50436631
PNG
(CHEMBL2398280)
Show SMILES CC(N=Nc1ccc2ccccc2n1)c1ccc(o1)-c1cccc(C(O)=O)c1Cl |w:3.3|
Show InChI InChI=1S/C22H16ClN3O3/c1-13(25-26-20-12-9-14-5-2-3-8-17(14)24-20)18-10-11-19(29-18)15-6-4-7-16(21(15)23)22(27)28/h2-13H,1H3,(H,27,28)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay


J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair