BDBM50367778 CHEMBL1202673

SMILES: CCCCN(CCCC)CCCOc1ccc(cc1)-c1nc(sc1C)-c1ccccc1

InChI Key: InChIKey=QJBVCJXTFJBKBP-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50367778   

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
Potassium-transporting ATPase alpha chain 1/beta chain (Homo sapiens (Human))	BDBM50367778 (CHEMBL1202673) Show SMILES CCCCN(CCCC)CCCOc1ccc(cc1)-c1nc(sc1C)-c1ccccc1 Show InChI InChI=1S/C27H36N2OS/c1-4-6-18-29(19-7-5-2)20-11-21-30-25-16-14-23(15-17-25)26-22(3)31-27(28-26)24-12-9-8-10-13-24/h8-10,12-17H,4-7,11,18-21H2,1-3H3	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Ortho Pharmaceutical Corporation Curated by ChEMBL					Assay Description Antisecretory activity evaluated by the inhibition of 14C -AP uptake in isolated rabbit parietal cells stimulated by dibutyryl cyclic adenosine 3', 5...				J Med Chem 31: 1778-85 (1988) BindingDB Entry DOI: 10.7270/Q20P10MZ
					More data for this Ligand-Target Pair
Potassium-transporting ATPase alpha chain 1/beta chain (Homo sapiens (Human))	BDBM50367778 (CHEMBL1202673) Show SMILES CCCCN(CCCC)CCCOc1ccc(cc1)-c1nc(sc1C)-c1ccccc1 Show InChI InChI=1S/C27H36N2OS/c1-4-6-18-29(19-7-5-2)20-11-21-30-25-16-14-23(15-17-25)26-22(3)31-27(28-26)24-12-9-8-10-13-24/h8-10,12-17H,4-7,11,18-21H2,1-3H3	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
Ortho Pharmaceutical Corporation Curated by ChEMBL					Assay Description Antisecretory activity evaluated by the inhibition of 14C -AP uptake in isolated rabbit parietal cells stimulated by exogenous histamine				J Med Chem 31: 1778-85 (1988) BindingDB Entry DOI: 10.7270/Q20P10MZ
					More data for this Ligand-Target Pair