BDBM50373300 CHEMBL256943

SMILES: CN1CCC(CC1)c1ccc(NC(=O)Nc2ccccc2Oc2cc(C)nn2-c2ccccc2Cl)cc1

InChI Key: InChIKey=LYYDOKNMJCIZNV-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 = 50373300   

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))	BDBM50373300 (CHEMBL256943) Show SMILES CN1CCC(CC1)c1ccc(NC(=O)Nc2ccccc2Oc2cc(C)nn2-c2ccccc2Cl)cc1 Show InChI InChI=1S/C29H30ClN5O2/c1-20-19-28(35(33-20)26-9-5-3-7-24(26)30)37-27-10-6-4-8-25(27)32-29(36)31-23-13-11-21(12-14-23)22-15-17-34(2)18-16-22/h3-14,19,22H,15-18H2,1-2H3,(H2,31,32,36)	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