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BDBM199125 N-(4-(1-(4,6-bis(o-tolylamino)-1,3,5-triazin-2-yl)-5-(4-methoxyphenyl)-1H-pyrazol-3-yl)phenyl)-4-methylbenzenesulphonamide (8g)

SMILES: COc1ccc(cc1)-c1cc(nn1-c1nc(Nc2ccccc2C)nc(Nc2ccccc2C)n1)-c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1

InChI Key: InChIKey=HBFSVAVZJFTMSI-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 = 199125   
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
Matrix metalloproteinase-9 (MMP-9)


(Rattus norvegicus (Rat))
BDBM199125
PNG
(N-(4-(1-(4,6-bis(o-tolylamino)-1,3,5-triazin-2-yl)...)
Show SMILES COc1ccc(cc1)-c1cc(nn1-c1nc(Nc2ccccc2C)nc(Nc2ccccc2C)n1)-c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C40H36N8O3S/c1-26-13-23-33(24-14-26)52-51-50-47-31-19-15-29(16-20-31)36-25-37(30-17-21-32(49-4)22-18-30)48(46-36)40-44-38(41-34-11-7-5-9-27(34)2)43-39(45-40)42-35-12-8-6-10-28(35)3/h5-25,47H,1-4H3,(H2,41,42,43,44,45)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 58.2n/an/an/an/a7.525



Zhejiang Hospital



Assay Description
where a pro-fluorescing peptide is used as substrate, and the fluorogenic activity of its cleavage product is measured after co-incubation with the a...


Chem Biol Drug Des 88: 756-765 (2016)


Article DOI: 10.1111/cbdd.12807
BindingDB Entry DOI: 10.7270/Q2ZW1JR4
More data for this
Ligand-Target Pair
Matrix metalloproteinase-2 (MMP-2)


(Rattus norvegicus (Rat))
BDBM199125
PNG
(N-(4-(1-(4,6-bis(o-tolylamino)-1,3,5-triazin-2-yl)...)
Show SMILES COc1ccc(cc1)-c1cc(nn1-c1nc(Nc2ccccc2C)nc(Nc2ccccc2C)n1)-c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C40H36N8O3S/c1-26-13-23-33(24-14-26)52-51-50-47-31-19-15-29(16-20-31)36-25-37(30-17-21-32(49-4)22-18-30)48(46-36)40-44-38(41-34-11-7-5-9-27(34)2)43-39(45-40)42-35-12-8-6-10-28(35)3/h5-25,47H,1-4H3,(H2,41,42,43,44,45)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 67.1n/an/an/an/a7.525



Zhejiang Hospital



Assay Description
where a pro-fluorescing peptide is used as substrate, and the fluorogenic activity of its cleavage product is measured after co-incubation with the a...


Chem Biol Drug Des 88: 756-765 (2016)


Article DOI: 10.1111/cbdd.12807
BindingDB Entry DOI: 10.7270/Q2ZW1JR4
More data for this
Ligand-Target Pair