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BDBM50086646 hydrogen (2-naphthyloxy)methylphosphonate

SMILES: OP([O-])(=O)COc1ccc2ccccc2c1

InChI Key: InChIKey=YJTVLRKHXZCXAI-UHFFFAOYSA-M

Data: 2 KI

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 = 50086646   
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
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50086646
PNG
(hydrogen (2-naphthyloxy)methylphosphonate)
Show SMILES OP([O-])(=O)COc1ccc2ccccc2c1
Show InChI InChI=1S/C11H11O4P/c12-16(13,14)8-15-11-6-5-9-3-1-2-4-10(9)7-11/h1-7H,8H2,(H2,12,13,14)/p-1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PubMed
1.30E+6n/an/an/an/an/an/an/an/a



New York University

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition constant against Protein-tyrosine phosphatase (PTP1B )


Bioorg Med Chem Lett 10: 457-60 (2000)


BindingDB Entry DOI: 10.7270/Q2J966W3
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (Human))
BDBM50086646
PNG
(hydrogen (2-naphthyloxy)methylphosphonate)
Show SMILES OP([O-])(=O)COc1ccc2ccccc2c1
Show InChI InChI=1S/C11H11O4P/c12-16(13,14)8-15-11-6-5-9-3-1-2-4-10(9)7-11/h1-7H,8H2,(H2,12,13,14)/p-1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PubMed
5.70E+6n/an/an/an/an/an/an/an/a



New York University

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition constant against dual specificity phosphatase VHR


Bioorg Med Chem Lett 10: 457-60 (2000)


BindingDB Entry DOI: 10.7270/Q2J966W3
More data for this
Ligand-Target Pair