BindingDB logo
myBDB logout

BDBM39475 5-amino-N-(2-furanylmethyl)-1-phenyl-4-triazolecarboxamide::5-amino-N-(2-furfuryl)-1-phenyl-triazole-4-carboxamide::5-amino-N-(2-furylmethyl)-1-phenyl-1H-1,2,3-triazole-4-carboxamide::5-amino-N-(furan-2-ylmethyl)-1-phenyltriazole-4-carboxamide::5-azanyl-N-(furan-2-ylmethyl)-1-phenyl-1,2,3-triazole-4-carboxamide::MLS000094752::SMR000030305::cid_3241170

SMILES: Nc1c(nnn1-c1ccccc1)C(=O)NCc1ccco1

InChI Key: InChIKey=IZSOBZCOTDKDMP-UHFFFAOYSA-N

Data: 2 EC50

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 = 39475   
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))
BDBM39475
PNG
(5-amino-N-(2-furanylmethyl)-1-phenyl-4-triazolecar...)
Show SMILES Nc1c(nnn1-c1ccccc1)C(=O)NCc1ccco1
Show InChI InChI=1S/C14H13N5O2/c15-13-12(14(20)16-9-11-7-4-8-21-11)17-18-19(13)10-5-2-1-3-6-10/h1-8H,9,15H2,(H,16,20)
PDB
MMDB

Reactome pathway
KEGG

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>3.67E+3n/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/Q24T6GSH
More data for this
Ligand-Target Pair
Steroidogenic Factor 1


(Homo sapiens (Human))
BDBM39475
PNG
(5-amino-N-(2-furanylmethyl)-1-phenyl-4-triazolecar...)
Show SMILES Nc1c(nnn1-c1ccccc1)C(=O)NCc1ccco1
Show InChI InChI=1S/C14H13N5O2/c15-13-12(14(20)16-9-11-7-4-8-21-11)17-18-19(13)10-5-2-1-3-6-10/h1-8H,9,15H2,(H,16,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 2.67E+3n/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/Q23T9FMP
More data for this
Ligand-Target Pair