BDBM50260240 CHEMBL4098653

SMILES: O=c1n(Cc2ccccc2)c(cc2onc(-c3ccccc3)c12)-c1ccc(CN2CCCC2)cc1

InChI Key: InChIKey=KXTBDIBPXYTNCC-UHFFFAOYSA-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 = 50260240   

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
dCTP pyrophosphatase 1 (Homo sapiens (Human))	BDBM50260240 (CHEMBL4098653) Show SMILES O=c1n(Cc2ccccc2)c(cc2onc(-c3ccccc3)c12)-c1ccc(CN2CCCC2)cc1 Show InChI InChI=1S/C30H27N3O2/c34-30-28-27(35-31-29(28)25-11-5-2-6-12-25)19-26(33(30)21-22-9-3-1-4-10-22)24-15-13-23(14-16-24)20-32-17-7-8-18-32/h1-6,9-16,19H,7-8,17-18,20-21H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karolinska Institutet Curated by ChEMBL					Assay Description Inhibitory activity against binding of Fibrinogen to thrombocyte alpha IIb beta-3 integrin				Bioorg Med Chem Lett 27: 3219-3225 (2017) Article DOI: 10.1016/j.bmcl.2017.06.039 BindingDB Entry DOI: 10.7270/Q29K4DPQ
					More data for this Ligand-Target Pair