BDBM482548 US10919852, Compound TABLE 1.247

SMILES: Cc1c(OCCCN2CC3(CCC3)C2)cccc1-c1cccc2[C@H](CCc12)Oc1cc(OCc2cc(cc(c2)C#N)C#N)c(CNC[C@@H]2CCC(=O)N2)cc1Cl

InChI Key: InChIKey=JPQILCIPJNRAEZ-ZMEFLVBSSA-N

Data: 1 IC50

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 = 482548   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Programmed cell death protein 1 (Homo sapiens)	BDBM482548 (US10919852, Compound TABLE 1.247) Show SMILES Cc1c(OCCCN2CC3(CCC3)C2)cccc1-c1cccc2[C@H](CCc12)Oc1cc(OCc2cc(cc(c2)C#N)C#N)c(CNC[C@@H]2CCC(=O)N2)cc1Cl |r| Show InChI InChI=1S/C46H48ClN5O4/c1-30-36(6-3-9-41(30)54-17-5-16-52-28-46(29-52)14-4-15-46)37-7-2-8-39-38(37)11-12-42(39)56-44-22-43(55-27-33-19-31(23-48)18-32(20-33)24-49)34(21-40(44)47)25-50-26-35-10-13-45(53)51-35/h2-3,6-9,18-22,35,42,50H,4-5,10-17,25-29H2,1H3,(H,51,53)/t35-,42-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<5	n/a	n/a	n/a	n/a	n/a	n/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)
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