BDBM50229710 CHEMBL4076784

SMILES: C(CCC1CCCCC1)CNc1nnc2SCCn12

InChI Key: InChIKey=BRDCVYNDQNVJTF-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 = 50229710   

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
Poly [ADP-ribose] polymerase tankyrase-2 (Homo sapiens (Human))	BDBM50229710 (CHEMBL4076784) Show SMILES C(CCC1CCCCC1)CNc1nnc2SCCn12 Show InChI InChI=1S/C14H24N4S/c1-2-6-12(7-3-1)8-4-5-9-15-13-16-17-14-18(13)10-11-19-14/h12H,1-11H2,(H,15,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	316	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universit£t Curated by ChEMBL					Assay Description Inhibition of tankyrase-2 (unknown origin)				J Med Chem 60: 1238-1246 (2017) BindingDB Entry DOI: 10.7270/Q2KK9F10
					More data for this Ligand-Target Pair