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BDBM50021189 5-Aminomethyl-4,5-dihydro-isoxazol-3-ol::CHEMBL40804

SMILES: NC[C@H]1CC(O)=NO1

InChI Key: InChIKey=ZHCZZTNIHDWRNS-GSVOUGTGSA-N

Data: 2 IC50

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 2 hits for monomerid = 50021189   
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
GABA transporter


(Rattus norvegicus)
BDBM50021189
PNG
(5-Aminomethyl-4,5-dihydro-isoxazol-3-ol | CHEMBL40...)
Show SMILES NC[C@H]1CC(O)=NO1
Show InChI InChI=1S/C4H8N2O2/c5-2-3-1-4(7)6-8-3/h3H,1-2,5H2,(H,6,7)/t3-/m1/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vivo inhibition of GABA uptake in rat brain synaptic membranes


J Med Chem 28: 1612-7 (1985)


Article DOI: 10.1021/jm00149a012
BindingDB Entry DOI: 10.7270/Q2PN94NZ
More data for this
Ligand-Target Pair
GABA receptor gamma-1 subunit


(Rattus norvegicus)
BDBM50021189
PNG
(5-Aminomethyl-4,5-dihydro-isoxazol-3-ol | CHEMBL40...)
Show SMILES NC[C@H]1CC(O)=NO1
Show InChI InChI=1S/C4H8N2O2/c5-2-3-1-4(7)6-8-3/h3H,1-2,5H2,(H,6,7)/t3-/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 250n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of [3H]-GABA binding to Gamma-aminobutyric-acid receptor of rat brain synaptic membranes


J Med Chem 28: 1612-7 (1985)


Article DOI: 10.1021/jm00149a012
BindingDB Entry DOI: 10.7270/Q2PN94NZ
More data for this
Ligand-Target Pair