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BDBM50034328 (3aS,9bS)-9-Methoxy-3-phenethyl-2,3,3a,4,5,9b-hexahydro-1H-benzo[e]indole::CHEMBL25638

SMILES: COc1cccc2CC[C@H]3[C@@H](CCN3CCc3ccccc3)c12

InChI Key: InChIKey=PPFLJANGUQOHFJ-MOPGFXCFSA-N

Data: 1 KI

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50034328   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50034328
PNG
((3aS,9bS)-9-Methoxy-3-phenethyl-2,3,3a,4,5,9b-hexa...)
Show SMILES COc1cccc2CC[C@H]3[C@@H](CCN3CCc3ccccc3)c12
Show InChI InChI=1S/C21H25NO/c1-23-20-9-5-8-17-10-11-19-18(21(17)20)13-15-22(19)14-12-16-6-3-2-4-7-16/h2-9,18-19H,10-15H2,1H3/t18-,19+/m1/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
442n/an/an/an/an/an/an/an/a



Arris Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
Tested for activity against 5-hydroxytryptamine 1A receptor from bovine hippocampus


J Med Chem 38: 1295-308 (1995)


BindingDB Entry DOI: 10.7270/Q2CJ8CJ9
More data for this
Ligand-Target Pair