Target Poor or Non Binder(s) Information
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T33966 | Target Info | |||
| Target Name | Carboxypeptidase A1 (CPA1) | ||||
| Synonyms |
CPA
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| Target Type | Literature-reported Target | ||||
| Gene Name | CPA1 | ||||
| Biochemical Class | Peptidase | ||||
| UniProt ID | |||||
| Poor Binders of This Target (in total, 8 binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
3-Pyridinepropanoic acid, 6-amino-alpha-1H-imidazol-5-yl-
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL302067; SCHEMBL2537437; 3-(6-aminopyridin-3-yl)-2-(1H-imidazol-5-yl)propanoic acid; BDBM50135933; DA-05473; FT-0737488; 3-(6-aminopyridin-3-yl)-2-(1H-imidazol-4-yl)propionic acid; 3-(6-Amino-pyridin-3-yl)-2-(1H-imidazol-4-yl)-propionic acid
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| Activity |
IC50 ~ 50000 nM
|
[1] | |||
| Compound Name |
(2S)-3-(4-Phenylphenyl)-2-[[(2S)-2-phenyl-2-sulfanylacetyl]amino]propanoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL437595; BDBM50411726; (2s)-3-biphenyl-4-yl-2-[[(2s)-2-phenyl-2-sulfanylacetyl]amino]propanoic acid
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| Activity |
Ki ~ 50000 nM
|
[2] | |||
| Compound Name |
(2s)-3-Biphenyl-4-yl-2-[(2-methyl-2-sulfanylpropanoyl)amino]-propanoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL404044; BDBM50411732
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| Activity |
Ki ~ 50000 nM
|
[2] | |||
| Compound Name |
Chembl4167456
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Investigative | Compound Info | ||
| Synonyms |
BDBM50283501
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| Activity |
Ki = 56000 nM
|
[3] | |||
| Compound Name |
Chembl4176703
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Investigative | Compound Info | ||
| Synonyms |
BDBM50283541
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| Activity |
Ki = 60400 nM
|
[3] | |||
| Compound Name |
2-(Nitromethyl)pent-4-enoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL259221; SCHEMBL11403666; BDBM50373035
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| Activity |
Ki = 62600 nM
|
[4] | |||
| Compound Name |
(2S)-2-Benzyl-3-nitropropanoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL261332; BDBM50373037
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| Activity |
Ki = 68000 nM
|
[4] | |||
| Compound Name |
Anabaenopeptin C
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3577334; BDBM50089686
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| Activity |
IC50 ~ 100000 nM
|
[5] | |||
| Click to Show/Hide the Information of All Poor Binders | |||||
| Non Binders of This Target (in total, 5 non binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
2-Benzyl-4-oxopentanoic acid
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL568460; SCHEMBL7322467; BDBM50301279; (+/-)-2-benzyl-4-oxopentanoic acid
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| Activity |
Ki = 207000 nM
|
[6] | |||
| Compound Name |
Chembl4168849
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Investigative | Compound Info | ||
| Synonyms |
BDBM50283502
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| Activity |
Ki = 238000 nM
|
[3] | |||
| Compound Name |
Chembl4173339
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Investigative | Compound Info | ||
| Synonyms |
BDBM50283499
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| Activity |
Ki = 289000 nM
|
[3] | |||
| Compound Name |
Chembl4172319
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Investigative | Compound Info | ||
| Synonyms |
BDBM50283495
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| Activity |
Ki = 294000 nM
|
[3] | |||
| Compound Name |
Chembl4165424
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Investigative | Compound Info | ||
| Synonyms |
BDBM50283497
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| Activity |
Ki = 413000 nM
|
[3] | |||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Synthesis and evaluation of imidazole acetic acid inhibitors of activated thrombin-activatable fibrinolysis inhibitor as novel antithrombotics. J Med Chem. 2003 Dec 4;46(25):5294-7. | ||||
| REF 2 | Thiol-based angiotensin-converting enzyme 2 inhibitors: P1 modifications for the exploration of the S1 subsite. Bioorg Med Chem Lett. 2008 Jan 15;18(2):732-7. | ||||
| REF 3 | Discovery of Mechanism-Based Inactivators for Human Pancreatic Carboxypeptidase A from a Focused Synthetic Library. ACS Med Chem Lett. 2017 Sep 22;8(10):1122-1127. | ||||
| REF 4 | Nitro as a novel zinc-binding group in the inhibition of carboxypeptidase A. Bioorg Med Chem. 2008 Apr 1;16(7):3596-601. | ||||
| REF 5 | Novel Small Molecule Inhibitors of Activated Thrombin Activatable Fibrinolysis Inhibitor (TAFIa) from Natural Product Anabaenopeptin. J Med Chem. 2015 Jun 11;58(11):4839-44. | ||||
| REF 6 | Characterization of alpha-nitromethyl ketone as a new zinc-binding group based on structural analysis of its complex with carboxypeptidase A. Bioorg Med Chem Lett. 2009 Sep 1;19(17):5009-11. | ||||
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