BDBM50091393 (4-(3-(1H-imidazol-4-yl)propyloxy)phenyl)ethanone semicarbazone with but-2-enedioic acid (0.5M H2O)::CHEMBL112681

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

InChI Key: InChIKey=GYWPLFKAZIVXBG-UHFFFAOYSA-N

Data: 1 KI  2 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 3 hits for monomerid = 50091393   

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))	BDBM50091393 ((4-(3-(1H-imidazol-4-yl)propyloxy)phenyl)ethanone ...) Show SMILES CC(=NNC(N)=O)c1ccc(OCCCc2cnc[nH]2)cc1 |w:2.2| Show InChI InChI=1S/C15H19N5O2/c1-11(19-20-15(16)21)12-4-6-14(7-5-12)22-8-2-3-13-9-17-10-18-13/h4-7,9-10H,2-3,8H2,1H3,(H,17,18)(H3,16,20,21)	Reactome pathway KEGG GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	8.30	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))	BDBM50091393 ((4-(3-(1H-imidazol-4-yl)propyloxy)phenyl)ethanone ...) Show SMILES CC(=NNC(N)=O)c1ccc(OCCCc2cnc[nH]2)cc1 |w:2.2| Show InChI InChI=1S/C15H19N5O2/c1-11(19-20-15(16)21)12-4-6-14(7-5-12)22-8-2-3-13-9-17-10-18-13/h4-7,9-10H,2-3,8H2,1H3,(H,17,18)(H3,16,20,21)	GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	2.51E+5	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
Histamine H2 receptor (Cavia porcellus (domestic guinea pig))	BDBM50091393 ((4-(3-(1H-imidazol-4-yl)propyloxy)phenyl)ethanone ...) Show SMILES CC(=NNC(N)=O)c1ccc(OCCCc2cnc[nH]2)cc1 |w:2.2| Show InChI InChI=1S/C15H19N5O2/c1-11(19-20-15(16)21)12-4-6-14(7-5-12)22-8-2-3-13-9-17-10-18-13/h4-7,9-10H,2-3,8H2,1H3,(H,17,18)(H3,16,20,21)	GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	1.58E+5	n/a	n/a	n/a	n/a	n/a
Freie Universität Berlin Curated by ChEMBL					Assay Description Histamine H2-receptor activity on isolated spontaneously beating guinea pig atrium				J Med Chem 43: 3335-43 (2000) BindingDB Entry DOI: 10.7270/Q2RR1XGV
					More data for this Ligand-Target Pair