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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 1A' and Ligand = 'BDBM50544113'   
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
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))		BDBM50544113
PNG
(CHEMBL4647189)
Show SMILES [Br-].C(C[N+]1(Cc2ccccc2)CCN(CC1)c1ncccn1)\N=C(\SCc1ccccc1)C12CC3CC(CC(C3)C1)C2 |TLB:23:32:35:39.37.38,THB:37:36:33:39.38.40,37:38:35.36.41:33,40:38:35:41.32.33,40:32:35:39.37.38|
Show InChI InChI=1S/C35H44N5S/c1-3-8-28(9-4-1)26-40(18-15-39(16-19-40)34-37-12-7-13-38-34)17-14-36-33(41-27-29-10-5-2-6-11-29)35-23-30-20-31(24-35)22-32(21-30)25-35/h1-13,30-32H,14-27H2/q+1/b36-33+
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 4.97E+3n/an/an/an/a



Dominican College

Curated by ChEMBL


Assay Description
Partial agonist activity at recombinant human 5-HT1A expressed in CHO-K1 cells by pathhunter beta-arrestin assay

Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127358
BindingDB Entry DOI: 10.7270/Q26113XJ
More data for this
Ligand-Target Pair