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SMILES: Cc1c(COc2cc(OCc3cncc(c3)C#N)c(CN[C@@H](CCCCN)C(O)=O)cc2Cl)cccc1-c1ccc2OCCOc2c1

InChI Key: InChIKey=MTLMPZDXYBMRRP-HKBQPEDESA-N

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 = 363430   
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
Programmed cell death 1 ligand 1


(Homo sapiens (Human))		BDBM363430
PNG
((S)-6-amino-2-((5-chloro-2-((5-cyanopyridin-3-yl)m...)
Show SMILES Cc1c(COc2cc(OCc3cncc(c3)C#N)c(CN[C@@H](CCCCN)C(O)=O)cc2Cl)cccc1-c1ccc2OCCOc2c1 |r|
Show InChI InChI=1S/C36H37ClN4O6/c1-23-27(5-4-6-29(23)26-8-9-32-35(15-26)45-12-11-44-32)22-47-34-16-33(46-21-25-13-24(17-39)18-40-19-25)28(14-30(34)37)20-41-31(36(42)43)7-2-3-10-38/h4-6,8-9,13-16,18-19,31,41H,2-3,7,10-12,20-22,38H2,1H3,(H,42,43)/t31-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 5.30n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The interaction of PD-1 and PD-L1 can be assessed using soluble, purified preparations of the extracellular domains of the two proteins. The PD-1 and...

US Patent US9850225 (2017)


BindingDB Entry DOI: 10.7270/Q2N018TZ
More data for this
Ligand-Target Pair