BDBM22544 4-(1H-imidazol-4-ylmethyl)benzonitrile::4-Benzyl-1H-imidazole derivative, 22
SMILES: N#Cc1ccc(Cc2cnc[nH]2)cc1
InChI Key: InChIKey=HLITWGOISFFJMV-UHFFFAOYSA-N
Data: 1 KI
PDB links: 2 PDB IDs contain this monomer as substructures. 2 PDB IDs contain inhibitors having a similarity of 90% to this monomer.
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 (Homo sapiens (Human)) | BDBM22544 (4-(1H-imidazol-4-ylmethyl)benzonitrile | 4-Benzyl-...) | Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Patents Similars | Article PubMed | 813 | -8.30 | n/a | n/a | n/a | n/a | n/a | 7.4 | 25 |
VU University Amsterdam | Assay Description Ligand displacement assays were performed on CHO cells membranes expressing hH3R. Retained radioactivity was determined by liquid scintillation count... | J Med Chem 51: 2944-53 (2008) Article DOI: 10.1021/jm7014149 BindingDB Entry DOI: 10.7270/Q24F1P2W | |||||||||||
More data for this Ligand-Target Pair |