BDBM50373314 CHEMBL258429

SMILES: CC(C)(C)c1ccc(NC(=O)Nc2ccccc2Oc2cc(nn2-c2ccccc2)C(O)=O)cc1

InChI Key: InChIKey=MHEXNTDQSGFDLC-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 = 50373314   

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))	BDBM50373314 (CHEMBL258429) Show SMILES CC(C)(C)c1ccc(NC(=O)Nc2ccccc2Oc2cc(nn2-c2ccccc2)C(O)=O)cc1 Show InChI InChI=1S/C27H26N4O4/c1-27(2,3)18-13-15-19(16-14-18)28-26(34)29-21-11-7-8-12-23(21)35-24-17-22(25(32)33)30-31(24)20-9-5-4-6-10-20/h4-17H,1-3H3,(H,32,33)(H2,28,29,34)	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