BDBM50064185 (2Z,4E)-5-(5,6-Dichloro-1H-indol-2-yl)-2-methoxy-penta-2,4-dienoic acid (3-diethylamino-propyl)-amide::CHEMBL39485

SMILES: CCN(CC)CCCNC(=O)C(\OC)=C\C=C\c1cc2cc(Cl)c(Cl)cc2[nH]1

InChI Key: InChIKey=QZHLOJGOYSUBAK-PSHJVPLCSA-N

Data: 3 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 3 hits for monomerid = 50064185   

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
Vacuolar H(+)-transporting ATPase 116 kDa subunit, a1 isoform (Gallus gallus)	BDBM50064185 ((2Z,4E)-5-(5,6-Dichloro-1H-indol-2-yl)-2-methoxy-p...) Show SMILES CCN(CC)CCCNC(=O)C(\OC)=C\C=C\c1cc2cc(Cl)c(Cl)cc2[nH]1 Show InChI InChI=1S/C21H27Cl2N3O2/c1-4-26(5-2)11-7-10-24-21(27)20(28-3)9-6-8-16-12-15-13-17(22)18(23)14-19(15)25-16/h6,8-9,12-14,25H,4-5,7,10-11H2,1-3H3,(H,24,27)/b8-6+,20-9-	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham S.p.A. Curated by ChEMBL					Assay Description Compound was tested for inhibititon of V-ATPase from Chicken adrenal glands(cAG)				J Med Chem 41: 1568-73 (1998) Article DOI: 10.1021/jm9800144 BindingDB Entry DOI: 10.7270/Q2CJ8CM6
					More data for this Ligand-Target Pair
Vacuolar ATP synthase subunit B, kidney isoform (Homo sapiens (Human))	BDBM50064185 ((2Z,4E)-5-(5,6-Dichloro-1H-indol-2-yl)-2-methoxy-p...) Show SMILES CCN(CC)CCCNC(=O)C(\OC)=C\C=C\c1cc2cc(Cl)c(Cl)cc2[nH]1 Show InChI InChI=1S/C21H27Cl2N3O2/c1-4-26(5-2)11-7-10-24-21(27)20(28-3)9-6-8-16-12-15-13-17(22)18(23)14-19(15)25-16/h6,8-9,12-14,25H,4-5,7,10-11H2,1-3H3,(H,24,27)/b8-6+,20-9-	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham S.p.A. Curated by ChEMBL					Assay Description Compound was tested for inhibititon of V-ATPase from human kidney cortex(hK)				J Med Chem 41: 1568-73 (1998) Article DOI: 10.1021/jm9800144 BindingDB Entry DOI: 10.7270/Q2CJ8CM6
					More data for this Ligand-Target Pair
Vacuolar H(+)-transporting ATPase 116 kDa subunit, a1 isoform (Gallus gallus)	BDBM50064185 ((2Z,4E)-5-(5,6-Dichloro-1H-indol-2-yl)-2-methoxy-p...) Show SMILES CCN(CC)CCCNC(=O)C(\OC)=C\C=C\c1cc2cc(Cl)c(Cl)cc2[nH]1 Show InChI InChI=1S/C21H27Cl2N3O2/c1-4-26(5-2)11-7-10-24-21(27)20(28-3)9-6-8-16-12-15-13-17(22)18(23)14-19(15)25-16/h6,8-9,12-14,25H,4-5,7,10-11H2,1-3H3,(H,24,27)/b8-6+,20-9-	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham S.p.A. Curated by ChEMBL					Assay Description Compound was tested for inhibititon of V-ATPase from Chicken adrenal glands(cAG)				J Med Chem 41: 1568-73 (1998) Article DOI: 10.1021/jm9800144 BindingDB Entry DOI: 10.7270/Q2CJ8CM6
					More data for this Ligand-Target Pair