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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Lysine-specific demethylase 5A' and Ligand = 'BDBM320401'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320401
PNG
(2-[hydroxy-(1-methylpyrazol-4- yl)methyl]-1H-pyrro...)
Show SMILES Cn1ccc(n1)C(O)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C13H12N4O3/c1-17-5-3-8(16-17)12(18)10-6-9-11(15-10)7(13(19)20)2-4-14-9/h2-6,12,15,18H,1H3,(H,19,20)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320401
PNG
(2-[hydroxy-(1-methylpyrazol-4- yl)methyl]-1H-pyrro...)
Show SMILES Cn1ccc(n1)C(O)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C13H12N4O3/c1-17-5-3-8(16-17)12(18)10-6-9-11(15-10)7(13(19)20)2-4-14-9/h2-6,12,15,18H,1H3,(H,19,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



CELGENE QUANTICEL RESEARCH, INC.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US10174026 (2019)

More data for this
Ligand-Target Pair