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BDBM71520 4-[benzyl(ethyl)sulfamoyl]-N-[3-(dimethylamino)propyl]-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)benzamide;hydrochloride::MLS001239279::N-[3-(dimethylamino)propyl]-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-4-[ethyl-(phenylmethyl)sulfamoyl]benzamide;hydrochloride::SMR000807896::cid_24891941

SMILES: CCN(Cc1ccccc1)S(=O)(=O)c1ccc(cc1)C(=O)N(CCCN(C)C)c1nc2cc(C)cc(C)c2s1

InChI Key: InChIKey=QMRHGBZSYDWTIK-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 71520   
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
ubiquitin-conjugating enzyme E2 N


(Homo sapiens (Human))
BDBM71520
PNG
(4-[benzyl(ethyl)sulfamoyl]-N-[3-(dimethylamino)pro...)
Show SMILES CCN(Cc1ccccc1)S(=O)(=O)c1ccc(cc1)C(=O)N(CCCN(C)C)c1nc2cc(C)cc(C)c2s1
Show InChI InChI=1S/C30H36N4O3S2/c1-6-33(21-24-11-8-7-9-12-24)39(36,37)26-15-13-25(14-16-26)29(35)34(18-10-17-32(4)5)30-31-27-20-22(2)19-23(3)28(27)38-30/h7-9,11-16,19-20H,6,10,17-18,21H2,1-5H3
PDB
MMDB

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PC cid
PC sid
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Similars

PCBioAssay
n/an/a>2.00E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2X34VX0
More data for this
Ligand-Target Pair