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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Programmed cell death protein 1' and Ligand = 'BDBM482354'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Programmed cell death protein 1


(Homo sapiens)		BDBM482354
PNG
(US10919852, Compound TABLE 1.53 | US11708326, Comp...)
Show SMILES C[C@@H](O)[C@H](NCc1cc(Cl)c(O[C@H]2CCc3c2cccc3-c2cccc(OCCCN3CCC(O)CC3)c2C)cc1OCc1cncc(c1)C#N)C(=O)NS(C)(=O)=O |r|
Show InChI InChI=1S/C43H50ClN5O8S/c1-27-33(7-5-10-38(27)55-18-6-15-49-16-13-32(51)14-17-49)34-8-4-9-36-35(34)11-12-39(36)57-41-21-40(56-26-30-19-29(22-45)23-46-24-30)31(20-37(41)44)25-47-42(28(2)50)43(52)48-58(3,53)54/h4-5,7-10,19-21,23-24,28,32,39,42,47,50-51H,6,11-18,25-26H2,1-3H3,(H,48,52)/t28-,39+,42+/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
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)


BindingDB Entry DOI: 10.7270/Q2RF5Z3R
More data for this
Ligand-Target Pair