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BDBM50542976 CHEMBL4636606

SMILES: Cc1c(Nc2cccc3cc(CNCCO)cnc23)cccc1-c1ccccc1

InChI Key: InChIKey=NHGZPWFRCNWOMB-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50542976   
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))		BDBM50542976
PNG
(CHEMBL4636606)
Show SMILES Cc1c(Nc2cccc3cc(CNCCO)cnc23)cccc1-c1ccccc1
Show InChI InChI=1S/C25H25N3O/c1-18-22(20-7-3-2-4-8-20)10-6-11-23(18)28-24-12-5-9-21-15-19(16-26-13-14-29)17-27-25(21)24/h2-12,15,17,26,28-29H,13-14,16H2,1H3
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PubMed
n/an/a<10n/an/an/an/an/an/a



Southern Medical University

Curated by ChEMBL


Assay Description
Inhibition of human Fc-tagged PD1 N-terminal domain (Leu25 to Gln167 residues) expressed in HEK293 cells/human His-tagged PDL1 (Phe19 to Arg238 resid...

J Med Chem 63: 8338-8358 (2020)

More data for this
Ligand-Target Pair