BDBM50158938 CHEMBL362231::Tris-(5-pyridin-3-yl-furan-2-ylmethyl)-amine

SMILES: C(N(Cc1ccc(o1)-c1cccnc1)Cc1ccc(o1)-c1cccnc1)c1ccc(o1)-c1cccnc1

InChI Key: InChIKey=ORRUGQHSIXFFQF-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 = 50158938   

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
Cytochrome P450 2A6 (Homo sapiens (Human))	BDBM50158938 (CHEMBL362231 | Tris-(5-pyridin-3-yl-furan-2-ylmeth...) Show SMILES C(N(Cc1ccc(o1)-c1cccnc1)Cc1ccc(o1)-c1cccnc1)c1ccc(o1)-c1cccnc1 Show InChI InChI=1S/C30H24N4O3/c1-4-22(16-31-13-1)28-10-7-25(35-28)19-34(20-26-8-11-29(36-26)23-5-2-14-32-17-23)21-27-9-12-30(37-27)24-6-3-15-33-18-24/h1-18H,19-21H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Human BioMolecular Research Institute Curated by ChEMBL					Assay Description Effect on coumarin 7-hydroxylation by human Cytochrome P-450 2A6				J Med Chem 48: 224-39 (2005) Article DOI: 10.1021/jm049696n BindingDB Entry DOI: 10.7270/Q2T154DB
					More data for this Ligand-Target Pair