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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Serotonin 2 (5-HT2) receptor' and Ligand = 'BDBM50081702'   
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
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50081702
PNG
(5-Methoxy-3-((S)-1-methyl-pyrrolidin-2-ylmethyl)-1...)
Show SMILES COc1ccc2[nH]cc(C[C@@H]3CCCN3C)c2c1
Show InChI InChI=1S/C15H20N2O/c1-17-7-3-4-12(17)8-11-10-16-15-6-5-13(18-2)9-14(11)15/h5-6,9-10,12,16H,3-4,7-8H2,1-2H3/t12-/m0/s1
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 680n/an/an/an/an/an/a



Pfizer, Inc

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 2 receptor using [125I]DOI as radioligand.


J Med Chem 35: 4503-5 (1992)


Article DOI: 10.1021/jm00101a032
BindingDB Entry DOI: 10.7270/Q29C6WC5
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50081702
PNG
(5-Methoxy-3-((S)-1-methyl-pyrrolidin-2-ylmethyl)-1...)
Show SMILES COc1ccc2[nH]cc(C[C@@H]3CCCN3C)c2c1
Show InChI InChI=1S/C15H20N2O/c1-17-7-3-4-12(17)8-11-10-16-15-6-5-13(18-2)9-14(11)15/h5-6,9-10,12,16H,3-4,7-8H2,1-2H3/t12-/m0/s1
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a>8.40E+3n/an/an/an/an/an/a



Pfizer, Inc

Curated by ChEMBL


Assay Description
Effect of the compound on forskolin stimulated adenylate cyclase activity at 5-HT1D receptor of guinea pig substantia nigra.


J Med Chem 35: 4503-5 (1992)


Article DOI: 10.1021/jm00101a032
BindingDB Entry DOI: 10.7270/Q29C6WC5
More data for this
Ligand-Target Pair