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SMILES: O=C(CN(Cc1cccs1)S(=O)(=O)c1ccc(cc1)S(=O)(=O)NC1CCCCC1)Nc1ccccc1

InChI Key: InChIKey=MFEDJQGOERVAHD-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 113864   
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
Disintegrin and metalloproteinase domain-containing protein 17


(Homo sapiens (Human))
BDBM113864
PNG
(2-[(4-Cyclohexylsulfamoyl-benzenesulfonyl)-thiophe...)
Show SMILES O=C(CN(Cc1cccs1)S(=O)(=O)c1ccc(cc1)S(=O)(=O)NC1CCCCC1)Nc1ccccc1
Show InChI InChI=1S/C25H29N3O5S3/c29-25(26-20-8-3-1-4-9-20)19-28(18-22-12-7-17-34-22)36(32,33)24-15-13-23(14-16-24)35(30,31)27-21-10-5-2-6-11-21/h1,3-4,7-9,12-17,21,27H,2,5-6,10-11,18-19H2,(H,26,29)
PDB
MMDB

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PC cid
PC sid
UniChem
PCBioAssay
n/an/a 6.95E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: Torrey Pines Institute for Molecul...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2DV1HJQ
More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 10


(Homo sapiens (Human))
BDBM113864
PNG
(2-[(4-Cyclohexylsulfamoyl-benzenesulfonyl)-thiophe...)
Show SMILES O=C(CN(Cc1cccs1)S(=O)(=O)c1ccc(cc1)S(=O)(=O)NC1CCCCC1)Nc1ccccc1
Show InChI InChI=1S/C25H29N3O5S3/c29-25(26-20-8-3-1-4-9-20)19-28(18-22-12-7-17-34-22)36(32,33)24-15-13-23(14-16-24)35(30,31)27-21-10-5-2-6-11-21/h1,3-4,7-9,12-17,21,27H,2,5-6,10-11,18-19H2,(H,26,29)
PDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 7.69E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: Torrey Pines Institute for Molecul...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2930RT9
More data for this
Ligand-Target Pair