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SMILES: Cc1c(OCCCN2CCC(F)CC2)cccc1-c1cccc2[C@H](CCc12)Oc1cc(OCc2cncc(c2)C#N)c(CNC[C@@H]2CCC(=O)N2)cc1Cl

InChI Key: InChIKey=RXCRAPAQNGZLKD-QQLMSYFVSA-N

Find this compound or compounds like it in BindingDB or PDB:
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 482446   
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)		BDBM482446
PNG
(US10919852, Compound TABLE 1.145)
Show SMILES Cc1c(OCCCN2CCC(F)CC2)cccc1-c1cccc2[C@H](CCc12)Oc1cc(OCc2cncc(c2)C#N)c(CNC[C@@H]2CCC(=O)N2)cc1Cl |r|
Show InChI InChI=1S/C43H47ClFN5O4/c1-28-34(5-3-8-39(28)52-18-4-15-50-16-13-32(45)14-17-50)35-6-2-7-37-36(35)10-11-40(37)54-42-21-41(53-27-30-19-29(22-46)23-47-24-30)31(20-38(42)44)25-48-26-33-9-12-43(51)49-33/h2-3,5-8,19-21,23-24,32-33,40,48H,4,9-18,25-27H2,1H3,(H,49,51)/t33-,40-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
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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