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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 = 'BDBM50260635'   
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))
BDBM50260635
PNG
(CHEMBL4062992)
Show SMILES Cc1nc2n(CCCC2(F)F)c(=O)c1CCN1CCN(CC1)c1nsc2ccccc12
Show InChI InChI=1S/C22H25F2N5OS/c1-15-16(20(30)29-9-4-8-22(23,24)21(29)25-15)7-10-27-11-13-28(14-12-27)19-17-5-2-3-6-18(17)31-26-19/h2-3,5-6H,4,7-14H2,1H3
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.30E+3n/an/an/an/a



Xinjiang Technical Institute of Physics and Chemistry

Curated by ChEMBL


Assay Description
Agonist activity at 5-HT1A receptor (unknown origin) after 60 mins by Ultra lance cAMP assay


Bioorg Med Chem 25: 4904-4916 (2017)


Article DOI: 10.1016/j.bmc.2017.07.040
BindingDB Entry DOI: 10.7270/Q2Z3222T
More data for this
Ligand-Target Pair