BDBM10799 (3R)-3-(prop-2-yn-1-ylamino)-2,3-dihydro-1H-inden-5-ol::6-hydroxy-N-propargyl-1(R)-aminoindan::Aminoindan deriv. (R)39u::CHEMBL371428::R-HPAI::rasagiline analogue

SMILES Oc1ccc2CC[C@@H](NCC#C)c2c1

InChI Key InChIKey=NRSDGDXUWMMUEV-UHFFFAOYSA-N

Data  3 KI  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 10799   

TargetAmine oxidase [flavin-containing] B(Rat)
Teva Pharmaceutical Industries

LigandPNGBDBM10799(rasagiline analogue | 6-hydroxy-N-propargyl-1(R)-a...)
Affinity DataIC50: 230nMAssay Description:The cholinesterase assays were performed using colorimetric method reported by Ellman. The absorbance changes at 412 nm were recorded for 5 min with ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2006
Entry Details Article
PubMed
TargetAmine oxidase [flavin-containing] A(Rat)
Teva Pharmaceutical Industries

LigandPNGBDBM10799(rasagiline analogue | 6-hydroxy-N-propargyl-1(R)-a...)
Affinity DataIC50: 300nMAssay Description:The cholinesterase assays were performed using colorimetric method reported by Ellman. The absorbance changes at 412 nm were recorded for 5 min with ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2006
Entry Details Article
PubMed
TargetAmine oxidase [flavin-containing] A(Human)
Emory University

LigandPNGBDBM10799(rasagiline analogue | 6-hydroxy-N-propargyl-1(R)-a...)
Affinity DataKi:  1.90E+3nM ΔG°:  -7.80kcal/molepH: 7.5 T: 2°CAssay Description:MAO A and MAO B activities were determined spectrophotometrically at 316 nm and 250 nm using kynuramine and benzylamine as substrates, respectively. ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/12/2006
Entry Details Article
PubMed
TargetAmine oxidase [flavin-containing] B(Human)
Emory University

LigandPNGBDBM10799(rasagiline analogue | 6-hydroxy-N-propargyl-1(R)-a...)
Affinity DataKi:  1.70E+4nM ΔG°:  -6.50kcal/molepH: 7.5 T: 2°CAssay Description:MAO A and MAO B activities were determined spectrophotometrically at 316 nm and 250 nm using kynuramine and benzylamine as substrates, respectively. ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/12/2006
Entry Details Article
PubMed
TargetAmine oxidase [flavin-containing] B(Human)
Emory University

LigandPNGBDBM10799(rasagiline analogue | 6-hydroxy-N-propargyl-1(R)-a...)
Affinity DataKi:  1.70E+4nMAssay Description:Inhibition constant against human recombinant Monoamine oxidase-B More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed