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SMILES: Cc1cc2cc(CNC(=O)c3ccc(C)c(c3)[N+]([O-])=O)ccc2[nH]1

InChI Key: InChIKey=XRFOBJRPGWMANT-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 3 hits for monomerid = 77730   
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
Mitochondrial import inner membrane translocase subunit TIM10


(Saccharomyces cerevisiae S288c)
BDBM77730
PNG
(4-methyl-N-[(2-methyl-1H-indol-5-yl)methyl]-3-nitr...)
Show SMILES Cc1cc2cc(CNC(=O)c3ccc(C)c(c3)[N+]([O-])=O)ccc2[nH]1
Show InChI InChI=1S/C18H17N3O3/c1-11-3-5-14(9-17(11)21(23)24)18(22)19-10-13-4-6-16-15(8-13)7-12(2)20-16/h3-9,20H,10H2,1-2H3,(H,19,22)
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MMDB

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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute(SBMRI, San Diego, CA...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2JQ0ZH4
More data for this
Ligand-Target Pair
Albumin


(Bos taurus)
BDBM77730
PNG
(4-methyl-N-[(2-methyl-1H-indol-5-yl)methyl]-3-nitr...)
Show SMILES Cc1cc2cc(CNC(=O)c3ccc(C)c(c3)[N+]([O-])=O)ccc2[nH]1
Show InChI InChI=1S/C18H17N3O3/c1-11-3-5-14(9-17(11)21(23)24)18(22)19-10-13-4-6-16-15(8-13)7-12(2)20-16/h3-9,20H,10H2,1-2H3,(H,19,22)
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n/an/a>9.41E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2RX99Q9
More data for this
Ligand-Target Pair
T cell receptor alpha variable 4


(Homo sapiens (Human))
BDBM77730
PNG
(4-methyl-N-[(2-methyl-1H-indol-5-yl)methyl]-3-nitr...)
Show SMILES Cc1cc2cc(CNC(=O)c3ccc(C)c(c3)[N+]([O-])=O)ccc2[nH]1
Show InChI InChI=1S/C18H17N3O3/c1-11-3-5-14(9-17(11)21(23)24)18(22)19-10-13-4-6-16-15(8-13)7-12(2)20-16/h3-9,20H,10H2,1-2H3,(H,19,22)
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UniProtKB/SwissProt

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n/an/a>9.41E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2WQ02FK
More data for this
Ligand-Target Pair