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2 similar compounds to monomer 50455770

Compile data set for download or QSAR
Wt: 261.1
BDBM50003582
Wt: 261.1
BDBM50368457

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50003582,50368457   
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
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50368457
PNG
(CHEMBL1788287)
Show SMILES C[C@H](N)Cc1ccc(I)cc1
Show InChI InChI=1S/C9H12IN/c1-7(11)6-8-2-4-9(10)5-3-8/h2-5,7H,6,11H2,1H3/t7-/m0/s1
PDB

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PC sid
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Similars

Article
PubMed
1.82E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Inhibition of [3H]PIA binding to rat cortical adenosine A1 receptor


J Med Chem 35: 4143-9 (1992)


Article DOI: 10.1021/jm00100a020
BindingDB Entry DOI: 10.7270/Q2XG9RSN
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50003582
PNG
((R-PIA)2-(4-Iodo-phenyl)-1-methyl-ethylamine | 2-(...)
Show SMILES CC(N)Cc1ccc(I)cc1
Show InChI InChI=1S/C9H12IN/c1-7(11)6-8-2-4-9(10)5-3-8/h2-5,7H,6,11H2,1H3
PDB

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CHEMBL
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PC sid
UniChem

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Article
PubMed
n/an/a 82n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Activity towards Serotonin transporter was determined by the ability to inhibit [3H]-5-HT uptake in rat synaptosomes


J Med Chem 41: 1001-5 (1998)


Article DOI: 10.1021/jm9705925
BindingDB Entry DOI: 10.7270/Q23777VQ
More data for this
Ligand-Target Pair
Norepinephrine Monoamine transporters


(Rattus norvegicus)
BDBM50003582
PNG
((R-PIA)2-(4-Iodo-phenyl)-1-methyl-ethylamine | 2-(...)
Show SMILES CC(N)Cc1ccc(I)cc1
Show InChI InChI=1S/C9H12IN/c1-7(11)6-8-2-4-9(10)5-3-8/h2-5,7H,6,11H2,1H3
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Article
PubMed
n/an/a 993n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Compound was tested for the ability to inhibit [3H]-norepinephrine binding to Norepinephrine transporter in rat synaptosomes


J Med Chem 41: 1001-5 (1998)


Article DOI: 10.1021/jm9705925
BindingDB Entry DOI: 10.7270/Q23777VQ
More data for this
Ligand-Target Pair