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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 = 'BDBM50135247'   
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))
BDBM50135247
PNG
((S)-1-[(2S,4R)-4-(4,6-Dimethoxy-benzo[b]thiophen-2...)
Show SMILES COc1cc(OC)c2cc(sc2c1)[C@@H]1CCN(C[C@H](O)COc2cccc3[nH]c(C)cc23)[C@@H](C)C1
Show InChI InChI=1S/C28H34N2O4S/c1-17-10-22-24(29-17)6-5-7-25(22)34-16-20(31)15-30-9-8-19(11-18(30)2)27-14-23-26(33-4)12-21(32-3)13-28(23)35-27/h5-7,10,12-14,18-20,29,31H,8-9,11,15-16H2,1-4H3/t18-,19+,20-/m0/s1
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Similars

PubMed
23n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair