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SMILES: CN1C[C@H]([C@@H](C1)c1ccccc1)C(=O)c1ccccn1

InChI Key: InChIKey=ZYZPGKZYHIMRSG-LSDHHAIUSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50099313   
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
Transporter


(Rattus norvegicus)
BDBM50099313
PNG
(((3S,4R)-1-Methyl-4-phenyl-pyrrolidin-3-yl)-pyridi...)
Show SMILES CN1C[C@H]([C@@H](C1)c1ccccc1)C(=O)c1ccccn1
Show InChI InChI=1S/C17H18N2O/c1-19-11-14(13-7-3-2-4-8-13)15(12-19)17(20)16-9-5-6-10-18-16/h2-10,14-15H,11-12H2,1H3/t14-,15+/m0/s1
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UniProtKB/TrEMBL

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PubMed
44n/an/an/an/an/an/an/an/a



Georgetown University Medical Center

Curated by ChEMBL


Assay Description
Inhibition of [3H]NE uptake at Norepinephrine transporter in rat parietal/occipital cortex was determined


Bioorg Med Chem Lett 11: 1113-8 (2001)


BindingDB Entry DOI: 10.7270/Q24M952F
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))
BDBM50099313
PNG
(((3S,4R)-1-Methyl-4-phenyl-pyrrolidin-3-yl)-pyridi...)
Show SMILES CN1C[C@H]([C@@H](C1)c1ccccc1)C(=O)c1ccccn1
Show InChI InChI=1S/C17H18N2O/c1-19-11-14(13-7-3-2-4-8-13)15(12-19)17(20)16-9-5-6-10-18-16/h2-10,14-15H,11-12H2,1H3/t14-,15+/m0/s1
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UniProtKB/SwissProt

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PC sid
UniChem

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PubMed
630n/an/an/an/an/an/an/an/a



Georgetown University Medical Center

Curated by ChEMBL


Assay Description
Inhibition of [3H]DA uptake at Dopamine transporter in rat cortex.


Bioorg Med Chem Lett 11: 1113-8 (2001)


BindingDB Entry DOI: 10.7270/Q24M952F
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50099313
PNG
(((3S,4R)-1-Methyl-4-phenyl-pyrrolidin-3-yl)-pyridi...)
Show SMILES CN1C[C@H]([C@@H](C1)c1ccccc1)C(=O)c1ccccn1
Show InChI InChI=1S/C17H18N2O/c1-19-11-14(13-7-3-2-4-8-13)15(12-19)17(20)16-9-5-6-10-18-16/h2-10,14-15H,11-12H2,1H3/t14-,15+/m0/s1
PDB

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830n/an/an/an/an/an/an/an/a



Georgetown University Medical Center

Curated by ChEMBL


Assay Description
Inhibition of [3H]5-HT uptake at Serotonin transporter in rat mid brain


Bioorg Med Chem Lett 11: 1113-8 (2001)


BindingDB Entry DOI: 10.7270/Q24M952F
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))
BDBM50099313
PNG
(((3S,4R)-1-Methyl-4-phenyl-pyrrolidin-3-yl)-pyridi...)
Show SMILES CN1C[C@H]([C@@H](C1)c1ccccc1)C(=O)c1ccccn1
Show InChI InChI=1S/C17H18N2O/c1-19-11-14(13-7-3-2-4-8-13)15(12-19)17(20)16-9-5-6-10-18-16/h2-10,14-15H,11-12H2,1H3/t14-,15+/m0/s1
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UniProtKB/SwissProt

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PC sid
UniChem

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PubMed
n/an/a 645n/an/an/an/an/an/a



Georgetown University Medical Center

Curated by ChEMBL


Assay Description
Inhibition of [3H]DA uptake at Dopamine transporter in rat cortex.


Bioorg Med Chem Lett 11: 1113-8 (2001)


BindingDB Entry DOI: 10.7270/Q24M952F
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))
BDBM50099313
PNG
(((3S,4R)-1-Methyl-4-phenyl-pyrrolidin-3-yl)-pyridi...)
Show SMILES CN1C[C@H]([C@@H](C1)c1ccccc1)C(=O)c1ccccn1
Show InChI InChI=1S/C17H18N2O/c1-19-11-14(13-7-3-2-4-8-13)15(12-19)17(20)16-9-5-6-10-18-16/h2-10,14-15H,11-12H2,1H3/t14-,15+/m0/s1
Reactome pathway
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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

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PubMed
n/an/a 494n/an/an/an/an/an/a



Georgetown University Medical Center

Curated by ChEMBL


Assay Description
Functional cocaine antagonism was evaluated by inhibition of [3H]dopamine reuptake at a concentration of 300 nM with cocaine


Bioorg Med Chem Lett 11: 1113-8 (2001)


BindingDB Entry DOI: 10.7270/Q24M952F
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))
BDBM50099313
PNG
(((3S,4R)-1-Methyl-4-phenyl-pyrrolidin-3-yl)-pyridi...)
Show SMILES CN1C[C@H]([C@@H](C1)c1ccccc1)C(=O)c1ccccn1
Show InChI InChI=1S/C17H18N2O/c1-19-11-14(13-7-3-2-4-8-13)15(12-19)17(20)16-9-5-6-10-18-16/h2-10,14-15H,11-12H2,1H3/t14-,15+/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 663n/an/an/an/an/an/a



Georgetown University Medical Center

Curated by ChEMBL


Assay Description
Functional cocaine antagonism was evaluated by inhibition of [3H]dopamine reuptake


Bioorg Med Chem Lett 11: 1113-8 (2001)


BindingDB Entry DOI: 10.7270/Q24M952F
More data for this
Ligand-Target Pair