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BDBM51891 2,5-dimethyl-4-[(phenylmethyl)-propan-2-ylsulfamoyl]-3-furancarboxylic acid methyl ester::4-[benzyl(isopropyl)sulfamoyl]-2,5-dimethyl-furan-3-carboxylic acid methyl ester::MLS000850406::SMR000456424::cid_2814454::methyl 2,5-dimethyl-4-[(phenylmethyl)-propan-2-yl-sulfamoyl]furan-3-carboxylate::methyl 4-[benzyl(propan-2-yl)sulfamoyl]-2,5-dimethylfuran-3-carboxylate::methyl 4-{[benzyl(isopropyl)amino]sulfonyl}-2,5-dimethyl-3-furoate

SMILES: COC(=O)c1c(C)oc(C)c1S(=O)(=O)N(Cc1ccccc1)C(C)C

InChI Key: InChIKey=GYLBIFHSUJJPOP-UHFFFAOYSA-N

Data: 2 EC50

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 = 51891   
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
Mitogen-activated protein kinase kinase kinase kinase 2


(Homo sapiens (Human))
BDBM51891
PNG
(2,5-dimethyl-4-[(phenylmethyl)-propan-2-ylsulfamoy...)
Show SMILES COC(=O)c1c(C)oc(C)c1S(=O)(=O)N(Cc1ccccc1)C(C)C
Show InChI InChI=1S/C18H23NO5S/c1-12(2)19(11-15-9-7-6-8-10-15)25(21,22)17-14(4)24-13(3)16(17)18(20)23-5/h6-10,12H,11H2,1-5H3
MMDB

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KEGG

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UniProtKB/TrEMBL

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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 3.00E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03MH084830-01 Project Title: TR-FRET HTS Assay for Inhibitors of MEKK2-MEK5 PB1 Domain...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q21Z42TP
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase kinase 2


(Homo sapiens (Human))
BDBM51891
PNG
(2,5-dimethyl-4-[(phenylmethyl)-propan-2-ylsulfamoy...)
Show SMILES COC(=O)c1c(C)oc(C)c1S(=O)(=O)N(Cc1ccccc1)C(C)C
Show InChI InChI=1S/C18H23NO5S/c1-12(2)19(11-15-9-7-6-8-10-15)25(21,22)17-14(4)24-13(3)16(17)18(20)23-5/h6-10,12H,11H2,1-5H3
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 3.00E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03MH084830-01 Project Title: TR-FRET HTS Assay for Inhibitors of MEKK2-MEK5 PB1 Domain...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q25Q4THK
More data for this
Ligand-Target Pair