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BDBM50542975 CHEMBL4644846

SMILES: Cc1c(COc2cc(OCc3cccc(c3)C#N)c(CNCCO)cc2Cl)cccc1-c1ccncc1

InChI Key: InChIKey=BSLJPNMIKWVMEB-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50542975   
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
PD-1/PD-L1


(Homo sapiens-Homo sapiens (Human))		BDBM50542975
PNG
(CHEMBL4644846)
Show SMILES Cc1c(COc2cc(OCc3cccc(c3)C#N)c(CNCCO)cc2Cl)cccc1-c1ccncc1
Show InChI InChI=1S/C30H28ClN3O3/c1-21-25(6-3-7-27(21)24-8-10-33-11-9-24)20-37-30-16-29(26(15-28(30)31)18-34-12-13-35)36-19-23-5-2-4-22(14-23)17-32/h2-11,14-16,34-35H,12-13,18-20H2,1H3
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PubMed
n/an/a>100n/an/an/an/an/an/a



Southern Medical University

Curated by ChEMBL


Assay Description
Inhibition of human PD1/PDL1 protein-protein interaction by HTRF assay

J Med Chem 63: 8338-8358 (2020)

More data for this
Ligand-Target Pair