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SMILES: C[C@@H](O)[C@H](NCc1cc(Cl)c(O[C@H]2CCc3c2cccc3-c2cccc(OCCCN3CC[C@@H](O)C3)c2C)cc1OCc1cncc(c1)C#N)C(O)=O

InChI Key: InChIKey=ROOQMDFQQLJPMK-KKBMZREZSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 482317   
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)		BDBM482317
PNG
(US10919852, Compound TABLE 1.16)
Show SMILES C[C@@H](O)[C@H](NCc1cc(Cl)c(O[C@H]2CCc3c2cccc3-c2cccc(OCCCN3CC[C@@H](O)C3)c2C)cc1OCc1cncc(c1)C#N)C(O)=O |r|
Show InChI InChI=1S/C41H45ClN4O7/c1-25-31(6-4-9-36(25)51-15-5-13-46-14-12-30(48)23-46)32-7-3-8-34-33(32)10-11-37(34)53-39-18-38(52-24-28-16-27(19-43)20-44-21-28)29(17-35(39)42)22-45-40(26(2)47)41(49)50/h3-4,6-9,16-18,20-21,26,30,37,40,45,47-48H,5,10-15,22-24H2,1-2H3,(H,49,50)/t26-,30-,37+,40+/m1/s1
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a<5n/an/an/an/an/an/a



ChemoCentryx, Inc.

US Patent


Assay Description
96 Well plates were coated with 1 g/mL of human PD-L1 (obtained from R&D) in PBS overnight at 4° C. The wells were then blocked with 2% BSA in PBS (W...

US Patent US10919852 (2021)

More data for this
Ligand-Target Pair