BDBM50108739 CHEMBL147407::[4-(4-Pyrimidin-4-yl-piperazin-1-yl)-pyrimidin-2-yl]-methanol

SMILES: OCc1nccc(n1)N1CCN(CC1)c1ccncn1

InChI Key: InChIKey=HXJDGRIVWBSSPP-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 = 50108739   

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
Sorbitol dehydrogenase (Homo sapiens (Human))	BDBM50108739 (CHEMBL147407 | [4-(4-Pyrimidin-4-yl-piperazin-1-yl...) Show SMILES OCc1nccc(n1)N1CCN(CC1)c1ccncn1 Show InChI InChI=1S/C13H16N6O/c20-9-11-15-4-2-13(17-11)19-7-5-18(6-8-19)12-1-3-14-10-16-12/h1-4,10,20H,5-9H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Concentration required for 50% in vitro inhibition in sheep liver sorbitol dehydrogenase (s-SDH)				J Med Chem 45: 511-28 (2002) BindingDB Entry DOI: 10.7270/Q2R210QX
					More data for this Ligand-Target Pair