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SMILES: Cc1c(COc2cc(OCc3cncc(c3)C#N)c(CN[C@@](C)(CO)C(O)=O)cc2Cl)cccc1-c1cccn(CCCN2CC[C@@H](O)C2)c1=O

InChI Key: InChIKey=DMTZFFWMPMJNHX-KLFBTDGFSA-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 = 436151   
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 protein 1


(Homo sapiens)		BDBM436151
PNG
(US10590105, Example 1037)
Show SMILES Cc1c(COc2cc(OCc3cncc(c3)C#N)c(CN[C@@](C)(CO)C(O)=O)cc2Cl)cccc1-c1cccn(CCCN2CC[C@@H](O)C2)c1=O |r|
Show InChI InChI=1S/C38H42ClN5O7/c1-25-28(6-3-7-31(25)32-8-4-11-44(36(32)47)12-5-10-43-13-9-30(46)21-43)23-51-35-16-34(50-22-27-14-26(17-40)18-41-19-27)29(15-33(35)39)20-42-38(2,24-45)37(48)49/h3-4,6-8,11,14-16,18-19,30,42,45-46H,5,9-10,12-13,20-24H2,1-2H3,(H,48,49)/t30-,38+/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 5.00E+3n/an/an/an/an/an/a



Bristol-Meyers 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 US10590105 (2020)


BindingDB Entry DOI: 10.7270/Q2ST7SVD
More data for this
Ligand-Target Pair