BDBM50373289 CHEMBL403824

SMILES: CCc1ccccc1-n1nc(C)cc1Oc1ccccc1NC(=O)Nc1ccc(nc1)C(F)(F)F

InChI Key: InChIKey=NEACKVWUVKVBMA-UHFFFAOYSA-N

Data: 1 KI

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 = 50373289   

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
Purinergic receptor P2Y1 (Homo sapiens (Human))	BDBM50373289 (CHEMBL403824) Show SMILES CCc1ccccc1-n1nc(C)cc1Oc1ccccc1NC(=O)Nc1ccc(nc1)C(F)(F)F Show InChI InChI=1S/C25H22F3N5O2/c1-3-17-8-4-6-10-20(17)33-23(14-16(2)32-33)35-21-11-7-5-9-19(21)31-24(34)30-18-12-13-22(29-15-18)25(26,27)28/h4-15H,3H2,1-2H3,(H2,30,31,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Binding affinity to human P2Y1 receptor				Bioorg Med Chem Lett 18: 3338-43 (2008) Article DOI: 10.1016/j.bmcl.2008.04.028 BindingDB Entry DOI: 10.7270/Q2X34Z95
					More data for this Ligand-Target Pair