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BDBM50345443 CHEMBL586157::N-(2,3-Dihydro1H-inden-5-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine::TCMDC-123574

SMILES: Cc1cc(Nc2ccc3CCCc3c2)n2ncnc2n1

InChI Key: InChIKey=FIPPPCYQTLUHCD-UHFFFAOYSA-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 = 50345443   
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
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Plasmodium falciparum)
BDBM50345443
PNG
(CHEMBL586157 | N-(2,3-Dihydro1H-inden-5-yl)-5-meth...)
Show SMILES Cc1cc(Nc2ccc3CCCc3c2)n2ncnc2n1
Show InChI InChI=1S/C15H15N5/c1-10-7-14(20-15(18-10)16-9-17-20)19-13-6-5-11-3-2-4-12(11)8-13/h5-9,19H,2-4H2,1H3
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 220n/an/an/an/an/an/a



University of Washington

Curated by ChEMBL


Assay Description
Inhibition of His6-tagged recombinant Plasmodium falciparum dihydroorotate dehydrogenase expressed in Escherichia coli using L-dihydroorotate as subs...


J Med Chem 54: 3935-49 (2011)


Article DOI: 10.1021/jm200265b
BindingDB Entry DOI: 10.7270/Q2FN16HS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50345443
PNG
(CHEMBL586157 | N-(2,3-Dihydro1H-inden-5-yl)-5-meth...)
Show SMILES Cc1cc(Nc2ccc3CCCc3c2)n2ncnc2n1
Show InChI InChI=1S/C15H15N5/c1-10-7-14(20-15(18-10)16-9-17-20)19-13-6-5-11-3-2-4-12(11)8-13/h5-9,19H,2-4H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of Washington

Curated by ChEMBL


Assay Description
Inhibition of His6-tagged recombinant human dihydroorotate dehydrogenase expressed in Escherichia coli using L-dihydroorotate as substrate after 10 t...


J Med Chem 54: 3935-49 (2011)


Article DOI: 10.1021/jm200265b
BindingDB Entry DOI: 10.7270/Q2FN16HS
More data for this
Ligand-Target Pair