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BDBM50118776 4-(Oxalyl-amino)-biphenyl-3-carboxylic acid::4-(carboxyformamido)biphenyl-3-carboxylic acid::CHEMBL344412

SMILES: OC(=O)C(=O)Nc1ccc(cc1C(O)=O)-c1ccccc1

InChI Key: InChIKey=XJCFHDSWTDSVGP-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 50118776   
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))
BDBM50118776
PNG
(4-(Oxalyl-amino)-biphenyl-3-carboxylic acid | 4-(c...)
Show SMILES OC(=O)C(=O)Nc1ccc(cc1C(O)=O)-c1ccccc1
Show InChI InChI=1S/C15H11NO5/c17-13(15(20)21)16-12-7-6-10(8-11(12)14(18)19)9-4-2-1-3-5-9/h1-8H,(H,16,17)(H,18,19)(H,20,21)
PDB
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Article
PubMed
1.40E+4n/an/an/an/an/an/a5.5n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibitory effect against recombinant human protein-tyrosine phosphatase 1B (PTP1B), using p-nitrophenyl phosphate substrate at pH 5.5.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118776
PNG
(4-(Oxalyl-amino)-biphenyl-3-carboxylic acid | 4-(c...)
Show SMILES OC(=O)C(=O)Nc1ccc(cc1C(O)=O)-c1ccccc1
Show InChI InChI=1S/C15H11NO5/c17-13(15(20)21)16-12-7-6-10(8-11(12)14(18)19)9-4-2-1-3-5-9/h1-8H,(H,16,17)(H,18,19)(H,20,21)
PDB
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Article
PubMed
1.41E+4n/an/an/an/an/an/an/an/a



Tsinghua University

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant PTP1B


Bioorg Med Chem Lett 20: 3329-37 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.033
BindingDB Entry DOI: 10.7270/Q27D2WCC
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase alpha


(Homo sapiens (Human))
BDBM50118776
PNG
(4-(Oxalyl-amino)-biphenyl-3-carboxylic acid | 4-(c...)
Show SMILES OC(=O)C(=O)Nc1ccc(cc1C(O)=O)-c1ccccc1
Show InChI InChI=1S/C15H11NO5/c17-13(15(20)21)16-12-7-6-10(8-11(12)14(18)19)9-4-2-1-3-5-9/h1-8H,(H,16,17)(H,18,19)(H,20,21)
PDB

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
2.80E+5n/an/an/an/an/an/a5.5n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibitory effect against human protein-tyrosine phosphatase alpha (PTPalpha), using p-nitrophenyl phosphate substrate at pH 5.5.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein phosphatase F (LAR)


(Homo sapiens (Human))
BDBM50118776
PNG
(4-(Oxalyl-amino)-biphenyl-3-carboxylic acid | 4-(c...)
Show SMILES OC(=O)C(=O)Nc1ccc(cc1C(O)=O)-c1ccccc1
Show InChI InChI=1S/C15H11NO5/c17-13(15(20)21)16-12-7-6-10(8-11(12)14(18)19)9-4-2-1-3-5-9/h1-8H,(H,16,17)(H,18,19)(H,20,21)
PDB
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Article
PubMed
7.00E+5n/an/an/an/an/an/a5.5n/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Inhibitory effect against protein-tyrosine phosphatase Lar, using p-nitrophenyl phosphate as substrate at pH 5.5.


J Med Chem 45: 4443-59 (2002)


Article DOI: 10.1021/jm0209026
BindingDB Entry DOI: 10.7270/Q2QJ7GM5
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50118776
PNG
(4-(Oxalyl-amino)-biphenyl-3-carboxylic acid | 4-(c...)
Show SMILES OC(=O)C(=O)Nc1ccc(cc1C(O)=O)-c1ccccc1
Show InChI InChI=1S/C15H11NO5/c17-13(15(20)21)16-12-7-6-10(8-11(12)14(18)19)9-4-2-1-3-5-9/h1-8H,(H,16,17)(H,18,19)(H,20,21)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Patents


Similars

PubMed
7.14E+13n/an/an/an/an/an/an/an/a



Graduate University of Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Binding affinity to PTP1B


Bioorg Med Chem Lett 15: 5521-5 (2005)


BindingDB Entry DOI: 10.7270/Q2TF0139
More data for this
Ligand-Target Pair