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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histamine H3 receptor' and Ligand = 'BDBM50119734'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50119734
PNG
(CHEMBL102283 | Cyclopropyl-{4-[3-((1S,4S)-5-ethane...)
Show SMILES CCS(=O)(=O)N1C[C@@H]2C[C@H]1CN2CCCOc1ccc(cc1)C(=O)C1CC1
Show InChI InChI=1S/C20H28N2O4S/c1-2-27(24,25)22-14-17-12-18(22)13-21(17)10-3-11-26-19-8-6-16(7-9-19)20(23)15-4-5-15/h6-9,15,17-18H,2-5,10-14H2,1H3/t17-,18-/m0/s1
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PC cid
PC sid
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PubMed
120n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity against rat histamine H3 receptor


Bioorg Med Chem Lett 12: 3055-8 (2002)


BindingDB Entry DOI: 10.7270/Q2B56J3P
More data for this
Ligand-Target Pair