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SMILES: Cn1ccc(n1)-c1nc(N)c(nc1-c1cc(Cl)c2ncccc2c1)C#N

InChI Key: InChIKey=CSJLPCOUSBKNRV-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 501684   
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
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM501684
PNG
(US11028058, Compound 1.309)
Show SMILES Cn1ccc(n1)-c1nc(N)c(nc1-c1cc(Cl)c2ncccc2c1)C#N
Show InChI InChI=1S/C18H12ClN7/c1-26-6-4-13(25-26)17-16(23-14(9-20)18(21)24-17)11-7-10-3-2-5-22-15(10)12(19)8-11/h2-8H,1H3,(H2,21,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a 1.60n/an/an/an/an/an/a



NUVATION BIO INC.

US Patent


Assay Description
For the A2A adenosine receptor radioligand binding assay, the following modifications were made to the general protocol. GF/C filters (Perkin Elmer, ...

US Patent US11028058 (2021)


BindingDB Entry DOI: 10.7270/Q23J3H46
More data for this
Ligand-Target Pair