BDBM50544703 CHEMBL4637457

SMILES: O\N=C1/C[C@H](N(C1=O)c1cccs1)C(=O)NCc1ccc(Cl)cc1Cl

InChI Key: InChIKey=ABRCUVAJIWIZPZ-DZUMZMOTSA-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 = 50544703   

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
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM50544703 (CHEMBL4637457) Show SMILES O\N=C1/C[C@H](N(C1=O)c1cccs1)C(=O)NCc1ccc(Cl)cc1Cl |r| Show InChI InChI=1S/C16H13Cl2N3O3S/c17-10-4-3-9(11(18)6-10)8-19-15(22)13-7-12(20-24)16(23)21(13)14-2-1-5-25-14/h1-6,13,24H,7-8H2,(H,19,22)/b20-12+/t13-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	3.72E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lille Curated by ChEMBL					Assay Description Inhibition of human P2X7 expressed in human HEK293 cells assessed as reduction in BzATP-stimulated TO-PRO-3 incorporation preincubated with compound ...				J Med Chem 63: 2074-2094 (2020)
					More data for this Ligand-Target Pair