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SMILES: COc1cc(cc(OC)c1OC)C(=O)NC(=S)NNC(=O)c1cnccn1

InChI Key: InChIKey=YKNJJKREQZTLPY-UHFFFAOYSA-N

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 = 4834   
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
Nuclear receptor coactivator 1


(Homo sapiens (Human))
BDBM4834
PNG
(cid_1881759)
Show SMILES COc1cc(cc(OC)c1OC)C(=O)NC(=S)NNC(=O)c1cnccn1
Show InChI InChI=1S/C16H17N5O5S/c1-24-11-6-9(7-12(25-2)13(11)26-3)14(22)19-16(27)21-20-15(23)10-8-17-4-5-18-10/h4-8H,1-3H3,(H,20,23)(H2,19,21,22,27)
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.46E+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


(Homo sapiens (Human))
BDBM4834
PNG
(cid_1881759)
Show SMILES COc1cc(cc(OC)c1OC)C(=O)NC(=S)NNC(=O)c1cnccn1
Show InChI InChI=1S/C16H17N5O5S/c1-24-11-6-9(7-12(25-2)13(11)26-3)14(22)19-16(27)21-20-15(23)10-8-17-4-5-18-10/h4-8H,1-3H3,(H,20,23)(H2,19,21,22,27)
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 3.58E+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) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2C24V0K
More data for this
Ligand-Target Pair