BDBM50091398 1-{4-[3-(1H-Imidazol-4-yl)-propoxy]-phenyl}-butan-1-one oxime; compound with but-2-enedioic acid (0.25M H2O)::CHEMBL112301

SMILES: CCCC(N=O)c1ccc(OCCCc2cnc[nH]2)cc1

InChI Key: InChIKey=IHBXUWBAUANWPO-UHFFFAOYSA-N

Data: 1 KI  1 Kd

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 = 50091398   

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
Histamine H3 receptor (Rattus norvegicus (rat))	BDBM50091398 (1-{4-[3-(1H-Imidazol-4-yl)-propoxy]-phenyl}-butan-...) Show SMILES CCCC(N=O)c1ccc(OCCCc2cnc[nH]2)cc1 Show InChI InChI=1S/C16H21N3O2/c1-2-4-16(19-20)13-6-8-15(9-7-13)21-10-3-5-14-11-17-12-18-14/h6-9,11-12,16H,2-5,10H2,1H3,(H,17,18)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Freie Universität Berlin Curated by ChEMBL					Assay Description Histamine H3 receptor antagonist activity in an assay with K+ evoked depolarization-induced release of [3H]-histamine from rat synaptosomes.				J Med Chem 43: 3335-43 (2000) BindingDB Entry DOI: 10.7270/Q2RR1XGV
					More data for this Ligand-Target Pair
Histamine H1 receptor (Cavia porcellus (domestic guinea pig))	BDBM50091398 (1-{4-[3-(1H-Imidazol-4-yl)-propoxy]-phenyl}-butan-...) Show SMILES CCCC(N=O)c1ccc(OCCCc2cnc[nH]2)cc1 Show InChI InChI=1S/C16H21N3O2/c1-2-4-16(19-20)13-6-8-15(9-7-13)21-10-3-5-14-11-17-12-18-14/h6-9,11-12,16H,2-5,10H2,1H3,(H,17,18)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a
Freie Universität Berlin Curated by ChEMBL					Assay Description Histamine H1-receptor activity on isolated guinea pig ileum				J Med Chem 43: 3335-43 (2000) BindingDB Entry DOI: 10.7270/Q2RR1XGV
					More data for this Ligand-Target Pair