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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 = 'BDBM482438'   
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)		BDBM482438
PNG
(US10919852, Compound TABLE 1.137 | US11708326, Com...)
Show SMILES OC1CN(CCCOc2cccc(c2Cl)-c2cccc3[C@H](CCc23)Oc2cc(OCc3cncc(c3)C#N)c(CN3CCCC4(C3)NC(=O)NC4=O)cc2Cl)C1 |r|
Show InChI InChI=1S/C42H42Cl2N6O6/c43-34-16-28(21-50-12-3-11-42(25-50)40(52)47-41(53)48-42)37(55-24-27-15-26(18-45)19-46-20-27)17-38(34)56-35-10-9-31-30(5-1-6-32(31)35)33-7-2-8-36(39(33)44)54-14-4-13-49-22-29(51)23-49/h1-2,5-8,15-17,19-20,29,35,51H,3-4,9-14,21-25H2,(H2,47,48,52,53)/t35-,42?/m0/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