Reaction Details Report a problem with these data
Target
Histamine H3 receptor
Ligand
BDBM50525813
Substrate
n/a
Meas. Tech.
ChEMBL_1898254 (CHEMBL4400289)
Ki
2.0±n/a nM
Citation
 Ledneczki, I; Némethy, Z; Tapolcsányi, P; Éles, J; Greiner, I; Gábor, E; Varga, B; Balázs, O; Román, V; Lévay, G; Mahó, S Discovery of novel steroidal histamine H Bioorg Med Chem Lett 29:0 (2019) [PubMed]  Article 
Target
Name:
Histamine H3 receptor
Synonyms:
G-protein coupled receptor 97 | GPCR97 | HH3R | HISTAMINE H3 | HRH3 | HRH3_HUMAN | Histamine H3 receptor (H3) | Histamine H3L | Histamine receptor (H3 and H4)
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
48691.47
Organism:
Homo sapiens (Human)
Description:
Binding assays were using CHO cells stably expressing hH3R receptors.
Residue:
445
Sequence:
MERAPPDGPLNASGALAGEAAAAGGARGFSAAWTAVLAALMALLIVATVLGNALVMLAFVADSSLRTQNNFFLLNLAISDFLVGAFCIPLYVPYVLTGRWTFGRGLCKLWLVVDYLLCTSSAFNIVLISYDRFLSVTRAVSYRAQQGDTRRAVRKMLLVWVLAFLLYGPAILSWEYLSGGSSIPEGHCYAEFFYNWYFLITASTLEFFTPFLSVTFFNLSIYLNIQRRTRLRLDGAREAAGPEPPPEAQPSPPPPPGCWGCWQKGHGEAMPLHRYGVGEAAVGAEAGEATLGGGGGGGSVASPTSSSGSSSRGTERPRSLKRGSKPSASSASLEKRMKMVSQSFTQRFRLSRDRKVAKSLAVIVSIFGLCWAPYTLLMIIRAACHGHCVPDYWYETSFWLLWANSAVNPVLYPLCHHSFRRAFTKLLCPQKLKIQPHSSLEHCWK
  
Inhibitor
Name:
BDBM50525813
Synonyms:
CHEMBL4579337
Type:
Small organic molecule
Emp. Form.:
C31H46N2O2
Mol. Mass.:
478.7091
SMILES:
[H][C@@]12CC[C@H](C(=O)N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC[C@H]4C)cc3CC[C@@]21[H] |r|
Structure:
Search PDB for entries with ligand similarity: