Target Poor or Non Binder(s) Information
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T57034 | Target Info | |||
| Target Name | Protein tyrosine phosphatase beta (PTPRB) | ||||
| Synonyms |
Vascular endothelial protein tyrosine phosphatase; VE-PTP; Receptor-type tyrosine-protein phosphatase beta; R-PTP-beta; PTPRB
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| Target Type | Clinical trial Target | ||||
| Gene Name | PTPRB | ||||
| Biochemical Class | Phosphoric monoester hydrolase | ||||
| UniProt ID | |||||
| Poor Binders of This Target (in total, 12 binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
N-{2-[4-(4-Fluorophenyl)piperazin-1-yl]-1-methyl-2-thien-2-ylethyl}-N'-(pyridin-3-ylmethyl)ethanediamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1773181; BDBM50343148; MCULE-8576155103
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| Activity |
IC50 ~ 50000 nM
|
[1] | |||
| Compound Name |
2-Oxo-2-[4-[[2-oxo-2-(4-propan-2-ylanilino)acetyl]amino]anilino]-1-phenylethanesulfonic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3609375; SCHEMBL18281593; BDBM50112357
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| Activity |
IC50 ~ 50000 nM
|
[2] | |||
| Compound Name |
2-[4-[[2-(4-Iodoanilino)-2-oxoacetyl]amino]anilino]-2-oxo-1-phenylethanesulfonic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3609373; SCHEMBL18281622; BDBM50112356; IC1=CC=C(C=C1)NC(C(=O)NC1=CC=C(C=C1)NC(C(S(=O)(=O)O)C1=CC=CC=C1)=O)=O
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| Activity |
IC50 ~ 50000 nM
|
[2] | |||
| Compound Name |
2-Oxo-2-[4-[[2-oxo-2-(4-phenylanilino)acetyl]amino]anilino]-1-phenylethanesulfonic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3609374; SCHEMBL18289745; BDBM50112358
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| Activity |
IC50 ~ 50000 nM
|
[2] | |||
| Compound Name |
N-(4-Butylphenyl)-2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1773168; Oprea1_072325; Oprea1_160592; ZINC2184757; BDBM50343142; STL224021; AKOS002276777; MCULE-2878647302; ST45174155; AQ-390/10779040; SR-01000481320; SR-01000481320-1; F0884-0032
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| Activity |
IC50 = 59400 nM
|
[1] | |||
| Compound Name |
[4-(Acetylamino)-3,5-dimethylphenoxy]acetic acid
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Investigative | Compound Info | ||
| Synonyms |
NSC38042; 2-(4-acetamido-3,5-dimethylphenoxy)acetic acid; MLS000738174; CHEMBL1358072; NSC-38042; (4-(acetylamino)-3,5-dimethylphenoxy)acetic acid; NCIStruc1_000324; NCIStruc2_000618; CTK5B8875; DTXSID30284619; HMS2754A14; NCI38042; ZINC1670393; BDBM50441457; CCG-37929; NCGC00013440; NCGC00013440-02; NCGC00096555-01; NCI60_003595; SMR000393932
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| Activity |
Ki = 73200 nM
|
[3] | |||
| Compound Name |
[(4-{3-[4-(Difluoro-phosphono-methyl)-benzyloxy]-phenoxymethyl}-phenyl)-difluoro-methyl]-phosphonic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL140524; SCHEMBL13727362; BDBM50107740; [m-Phenylenebis[(oxymethylene-p-phenylene)(difluoromethylene)]]bis(phosphonic acid)
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| Activity |
IC50 = 77000 nM
|
[4] | |||
| Compound Name |
[(4-{2-[4-(Difluoro-phosphono-methyl)-benzyloxy]-phenoxymethyl}-phenyl)-difluoro-methyl]-phosphonic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL337604; BDBM50107744; [o-Phenylenebis[(oxymethylene-p-phenylene)(difluoromethylene)]]bis(phosphonic acid)
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| Activity |
IC50 = 77000 nM
|
[4] | |||
| Compound Name |
(4-(4-Bromo-3,5-bis(trifluoromethyl)phenylcarbamoyl)phenyl)difluoromethylphosphonic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1081579; BDBM50312261; [[4-[[4-bromo-3,5-bis(trifluoromethyl)phenyl]carbamoyl]phenyl]-difluoro-methyl]phosphonic acid
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| Activity |
Ki ~ 100000 nM
|
[5] | |||
| Compound Name |
10,13-Dimethyl-17-[2-(6-sulfanylidene-3H-purin-9-yl)acetyl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
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Investigative | Compound Info | ||
| Synonyms |
NSC114792; CHEMBL1254103; NSC-114792; SCHEMBL15499041; CTK4D4821; DTXSID10409207; BDBM50326558; NCI60_000338
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| Activity |
IC50 = 135000 nM
|
[6] | |||
| Compound Name |
(1-Amino-2-phenylethyl)phosphonic acid
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Investigative | Compound Info | ||
| Synonyms |
1-Amino-2-phenylethylphosphonic acid; NSC30080; NSC 30080; Oprea1_662395; alpha-Amino-beta-phenylethylphosphonic acid; NSC-30080; Phosphonic acid, (1-amino-2-phenylethyl)-; SCHEMBL2375608; CHEMBL1090913; CTK5B8256; alpha-Aminophenethylphosphonic acid; NCI60_002524; Phosphonic acid,P-(1-amino-2-phenylethyl)-; (1-azaniumyl-2-phenylethyl)-hydroxyphosphinate
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| Activity |
IC50 = 139000 nM
|
[6] | |||
| Compound Name |
3-(Carboxyformamido)thiophene-2-carboxylic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL336879; SCHEMBL5838354; BDBM50118779; N-(2-Carboxy-3-thienyl)oxamidic acid; 3-(Oxalyl-amino)-thiophene-2-carboxylic acid
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| Activity |
Ki = 160000 nM
|
[7] | |||
| Click to Show/Hide the Information of All Poor Binders | |||||
| Non Binders of This Target (in total, 4 non binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
Cefsulodin sodium salt
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3351077; BDBM50282169; SDCCGSBI-0050247.P002
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| Activity |
IC50 > 200000 nM
|
[2] | |||
| Compound Name |
Azane;[[4-[2-[[4-[difluoro(phosphono)methyl]phenyl]methoxy]ethoxymethyl]phenyl]-difluoromethyl]phosphonic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL344437
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| Activity |
IC50 = 300000 nM
|
[4] | |||
| Compound Name |
[(4-{4-[4-(Difluoro-phosphono-methyl)-phenyl]-butyl}-phenyl)-difluoro-methyl]-phosphonic acid
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Investigative | Compound Info | ||
| Synonyms |
SCHEMBL4316970; CHEMBL1161222; DB04204; Q27095031; Tetramethylenebis[(p-phenylene)(difluoromethylene)]bis(phosphonic acid); {butane-1,4-diylbis[benzene-4,1-diyl(difluoromethanediyl)]}bis(phosphonic acid)
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| Activity |
IC50 = 342000 nM
|
[4] | |||
| Compound Name |
2-(Oxalyl-amino)-4,5,6,7-tetrahydro-thieno[2,3-C]pyridine-3-carboxylic acid
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Investigative | Compound Info | ||
| Synonyms |
TCS-401; CHEMBL139393; 2-(oxaloamino)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylic acid; SCHEMBL4293286; TCS 401 pound>>TCS401; BCP29628; ZINC1551920; BDBM50118792; DB03670; Q27094586; N-(3-Carboxy-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-2-yl)oxamidic acid; 2-(carboxyformamido)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylic acid
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| Activity |
Ki = 560000 nM
|
[7] | |||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Identification and characterization of novel inhibitors of mPTPB, an essential virulent phosphatase from Mycobacterium tuberculosis. ACS Med Chem Lett. 2010 Oct 14;1(7):355-359. | ||||
| REF 2 | Exploring the Existing Drug Space for Novel pTyr Mimetic and SHP2 Inhibitors. ACS Med Chem Lett. 2015 Jun 8;6(7):782-6. | ||||
| REF 3 | Identification of new inhibitors for low molecular weight protein tyrosine phosphatase isoform B. Bioorg Med Chem Lett. 2013 Nov 1;23(21):5912-4. | ||||
| REF 4 | Structure of protein tyrosine phosphatase 1B in complex with inhibitors bearing two phosphotyrosine mimetics. J Med Chem. 2001 Dec 20;44(26):4584-94. | ||||
| REF 5 | Fragment-based discovery of selective inhibitors of the Mycobacterium tuberculosis protein tyrosine phosphatase PtpA. Bioorg Med Chem Lett. 2009 Dec 15;19(24):6851-4. | ||||
| REF 6 | Identification of novel inhibitors for a low molecular weight protein tyrosine phosphatase via virtual screening. Bioorg Med Chem. 2010 Jul 15;18(14):5449-56. | ||||
| REF 7 | Knowledge-based characterization of similarity relationships in the human protein-tyrosine phosphatase family for rational inhibitor design. J Med Chem. 2009 Nov 12;52(21):6649-59. | ||||
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