BindingDB logo
myBDB logout

1 similar compounds to monomer 32689

Compile data set for download or QSAR
Wt: 393.5
BDBM39084

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 39084   
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 ROR-alpha


(Homo sapiens (Human))
BDBM39084
PNG
(3-(2-furanylmethyl)-9-methyl-N-(2-oxolanylmethyl)-...)
Show SMILES Cc1cccc2cc3CN(Cc4ccco4)\C(Sc3nc12)=N\CC1CCCO1
Show InChI InChI=1S/C22H23N3O2S/c1-15-5-2-6-16-11-17-13-25(14-19-8-4-10-27-19)22(28-21(17)24-20(15)16)23-12-18-7-3-9-26-18/h2,4-6,8,10-11,18H,3,7,9,12-14H2,1H3/b23-22-
PDB
MMDB

Reactome pathway
KEGG

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>3.30E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2TH8K3N
More data for this
Ligand-Target Pair
Hsf1 protein


(Mus musculus)
BDBM39084
PNG
(3-(2-furanylmethyl)-9-methyl-N-(2-oxolanylmethyl)-...)
Show SMILES Cc1cccc2cc3CN(Cc4ccco4)\C(Sc3nc12)=N\CC1CCCO1
Show InChI InChI=1S/C22H23N3O2S/c1-15-5-2-6-16-11-17-13-25(14-19-8-4-10-27-19)22(28-21(17)24-20(15)16)23-12-18-7-3-9-26-18/h2,4-6,8,10-11,18H,3,7,9,12-14H2,1H3/b23-22-
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 4.46E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2P55KXK
More data for this
Ligand-Target Pair
Steroidogenic Factor 1


(Homo sapiens (Human))
BDBM39084
PNG
(3-(2-furanylmethyl)-9-methyl-N-(2-oxolanylmethyl)-...)
Show SMILES Cc1cccc2cc3CN(Cc4ccco4)\C(Sc3nc12)=N\CC1CCCO1
Show InChI InChI=1S/C22H23N3O2S/c1-15-5-2-6-16-11-17-13-25(14-19-8-4-10-27-19)22(28-21(17)24-20(15)16)23-12-18-7-3-9-26-18/h2,4-6,8,10-11,18H,3,7,9,12-14H2,1H3/b23-22-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 6.37E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2PR7TCX
More data for this
Ligand-Target Pair