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SMILES: C(c1nnc2sc(nn12)-c1ccccn1)c1ccccc1

InChI Key: InChIKey=UZDPFXPTSKSULQ-UHFFFAOYSA-N

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 = 34463   
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
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM34463
PNG
(3-(phenylmethyl)-6-(2-pyridinyl)-[1,2,4]triazolo[3...)
Show SMILES C(c1nnc2sc(nn12)-c1ccccn1)c1ccccc1
Show InChI InChI=1S/C15H11N5S/c1-2-6-11(7-3-1)10-13-17-18-15-20(13)19-14(21-15)12-8-4-5-9-16-12/h1-9H,10H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem
PubMed
n/an/a 2.50E+4n/an/an/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Inhibition of KDM5A (unknown origin) using substrate peptide/ascorbate/2-OG/ Fe(2) as substrate preincubated for 15 mins followed by addition of subs...


Bioorg Med Chem Lett 26: 2284-8 (2016)


BindingDB Entry DOI: 10.7270/Q2XP76TS
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM34463
PNG
(3-(phenylmethyl)-6-(2-pyridinyl)-[1,2,4]triazolo[3...)
Show SMILES C(c1nnc2sc(nn12)-c1ccccn1)c1ccccc1
Show InChI InChI=1S/C15H11N5S/c1-2-6-11(7-3-1)10-13-17-18-15-20(13)19-14(21-15)12-8-4-5-9-16-12/h1-9H,10H2
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 3.69E+3n/an/an/an/a8.023



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
A fluorescence resonance energy transfer assay is developed in 96-well and 384-well microplate formats with robotic manipulation to enable high-throu...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2H70D5W
More data for this
Ligand-Target Pair