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SMILES: O=C1OC(N2CCN(Cc3ccccc3)CC2)c2ccccc12

InChI Key: InChIKey=RCGVBOHDRUDCFW-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 = 39539   
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
Isoform 2 of Nuclear receptor ROR-alpha (Alpha-2)


(Homo sapiens (Human))
BDBM39539
PNG
(3-(4-benzylpiperazin-1-yl)-3H-2-benzofuran-1-one |...)
Show SMILES O=C1OC(N2CCN(Cc3ccccc3)CC2)c2ccccc12
Show InChI InChI=1S/C19H20N2O2/c22-19-17-9-5-4-8-16(17)18(23-19)21-12-10-20(11-13-21)14-15-6-2-1-3-7-15/h1-9,18H,10-14H2
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a>9.90E+4n/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/Q2RJ4GVG
More data for this
Ligand-Target Pair
Steroidogenic factor 1


(Homo sapiens (Human))
BDBM39539
PNG
(3-(4-benzylpiperazin-1-yl)-3H-2-benzofuran-1-one |...)
Show SMILES O=C1OC(N2CCN(Cc3ccccc3)CC2)c2ccccc12
Show InChI InChI=1S/C19H20N2O2/c22-19-17-9-5-4-8-16(17)18(23-19)21-12-10-20(11-13-21)14-15-6-2-1-3-7-15/h1-9,18H,10-14H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a>9.90E+4n/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/Q2028PXQ
More data for this
Ligand-Target Pair