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BDBM50281573 3-Amino-propane-1-sulfonic acid::3-ammoniopropane-1-sulfonate::Aminopropanesulfonic-3::CHEMBL149082

SMILES: NCCCS(O)(=O)=O

InChI Key: InChIKey=SNKZJIOFVMKAOJ-UHFFFAOYSA-N

Data: 2 KI  2 IC50

PDB links: 1 PDB ID matches this monomer.

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 4 hits for monomerid = 50281573   
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
Gamma-aminobutyric acid type B receptor subunit 1


(Rattus norvegicus (Rat))
BDBM50281573
PNG
(3-Amino-propane-1-sulfonic acid | 3-ammoniopropane...)
Show SMILES NCCCS(O)(=O)=O
Show InChI InChI=1S/C3H9NO3S/c4-2-1-3-8(5,6)7/h1-4H2,(H,5,6,7)
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Article
PubMed
30n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




J Neurochem 32: 713-8 (1979)


Article DOI: 10.1111/j.1471-4159.1979.tb04553.x
BindingDB Entry DOI: 10.7270/Q29W0D0B
More data for this
Ligand-Target Pair
Proton-coupled amino acid transporter 1


(Homo sapiens (Human))
BDBM50281573
PNG
(3-Amino-propane-1-sulfonic acid | 3-ammoniopropane...)
Show SMILES NCCCS(O)(=O)=O
Show InChI InChI=1S/C3H9NO3S/c4-2-1-3-8(5,6)7/h1-4H2,(H,5,6,7)
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KEGG

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CHEMBL
KEGG
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Article
PubMed
7.10E+6n/an/an/an/an/an/an/an/a



Martin-Luther-University Halle-Wittenberg

Curated by ChEMBL


Assay Description
Inhibition of human PAT1-mediated L-[3H]proline uptake in human Caco2 cells after 10 mins by liquid scintillation counting


Bioorg Med Chem 19: 6409-18 (2011)

Checked by Author
Article DOI: 10.1016/j.bmc.2011.08.058
BindingDB Entry DOI: 10.7270/Q2NZ882D
More data for this
Ligand-Target Pair
GABA-B receptor 1/2


(Rattus norvegicus (Rat))
BDBM50281573
PNG
(3-Amino-propane-1-sulfonic acid | 3-ammoniopropane...)
Show SMILES NCCCS(O)(=O)=O
Show InChI InChI=1S/C3H9NO3S/c4-2-1-3-8(5,6)7/h1-4H2,(H,5,6,7)
PDB

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Article
n/an/a 3.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against Gamma-aminobutyric acid type B receptor in rat brain synaptosomes after 30 minutes


Bioorg Med Chem Lett 6: 1709-1714 (1996)


Article DOI: 10.1016/0960-894X(96)00307-1
BindingDB Entry DOI: 10.7270/Q22J6CCH
More data for this
Ligand-Target Pair
GABA-B receptor 1/2


(Rattus norvegicus (Rat))
BDBM50281573
PNG
(3-Amino-propane-1-sulfonic acid | 3-ammoniopropane...)
Show SMILES NCCCS(O)(=O)=O
Show InChI InChI=1S/C3H9NO3S/c4-2-1-3-8(5,6)7/h1-4H2,(H,5,6,7)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
Purchase

CHEMBL
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
n/an/a 2.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro displacement of [3H]-GABA from Gamma-aminobutyric acid type B receptor sites in rat brain membranes


Bioorg Med Chem Lett 3: 515-518 (1993)


Article DOI: 10.1016/S0960-894X(01)81218-X
BindingDB Entry DOI: 10.7270/Q2BR8S4N
More data for this
Ligand-Target Pair