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BDBM7004 cid_3265453

SMILES: CN(C1CCS(=O)(=O)C1)c1ncnc2sc3CCCc3c12

InChI Key: InChIKey=GMGYDFBSVHKIFV-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 = 7004   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Nuclear receptor coactivator 1


(Homo sapiens (Human))
BDBM7004
PNG
(cid_3265453)
Show SMILES CN(C1CCS(=O)(=O)C1)c1ncnc2sc3CCCc3c12
Show InChI InChI=1S/C14H17N3O2S2/c1-17(9-5-6-21(18,19)7-9)13-12-10-3-2-4-11(10)20-14(12)16-8-15-13/h8-9H,2-7H2,1H3
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 3.27E+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) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2794387
More data for this
Ligand-Target Pair
nuclear receptor coactivator 3 isoform a


(Homo sapiens (Human))
BDBM7004
PNG
(cid_3265453)
Show SMILES CN(C1CCS(=O)(=O)C1)c1ncnc2sc3CCCc3c12
Show InChI InChI=1S/C14H17N3O2S2/c1-17(9-5-6-21(18,19)7-9)13-12-10-3-2-4-11(10)20-14(12)16-8-15-13/h8-9H,2-7H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

Article
PCBioAssay
n/an/a 1.99E+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) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2012)


Article DOI: 10.1016/j.bioorg.2016.08.009
BindingDB Entry DOI: 10.7270/Q2C24V0K
More data for this
Ligand-Target Pair