| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 4th, 2005 | 33 | Yes |
Popular Name: AMASTATIN AMASTATIN
Find On: PubMed — Wikipedia — Google
CAS Numbers: 100938-10-1 , 100992-59-4 , 67655-94-1
(2R,3R)-AHMHA-Val-Val-Asp-OH HCl
Amastatin [67655-94-1]; ((Amino-2-hydroxy-5-methyl-hexanoyl)-L-valyl-L-valyl-L-aspartic acid)
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -2.99 | -6.99 | -129.12 | 7 | 12 | -1 | 215 | 473.547 | 14 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| UniProt Database Links | AMZ1_HUMAN; AMZ1_MOUSE; AMZ1_RAT; AMZ2_HUMAN; AMZ2_MACFA; AMZ2_MOUSE; AMZ2_PONAB; AMZ2_RAT; LAP1_TRIRU; LAP2_TRIRU; PEPT_FUSNP; PSA_HUMAN; PSA_MOUSE | ChEBI |
| Notes | Diastereoepimer of aminopeptidase inhibitor amastatin | Apollo Scientific Bioactives |
| Patent Database Links | EP1867323; US2007249541 | ChEBI |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| AMPE-1-E | Aminopeptidase A (cluster #1 Of 2), Eukaryotic | Eukaryotes | 8000 | 0.22 | Binding ≤ 10μM |
| AMPL-1-E | Leucine Aminopeptidase (cluster #1 Of 2), Eukaryotic | Eukaryotes | 30 | 0.32 | Binding ≤ 10μM |
| AMPN-2-E | Aminopeptidase N (cluster #2 Of 5), Eukaryotic | Eukaryotes | 200 | 0.28 | Binding ≤ 10μM |
| LCAP-1-E | Cystinyl Aminopeptidase (cluster #1 Of 1), Eukaryotic | Eukaryotes | 220 | 0.28 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| AMPN_HUMAN | P15144 | Aminopeptidase N, Human | 20 | 0.33 | Binding ≤ 1μM |
| LCAP_RAT | P97629 | Cystinyl Aminopeptidase, Rat | 20 | 0.33 | Binding ≤ 1μM |
| AMPL_HUMAN | P28838 | Leucine Aminopeptidase, Human | 220 | 0.28 | Binding ≤ 1μM |
| AMPE_HUMAN | Q07075 | Aminopeptidase A, Human | 8000 | 0.22 | Binding ≤ 10μM |
| AMPN_HUMAN | P15144 | Aminopeptidase N, Human | 1100 | 0.25 | Binding ≤ 10μM |
| LCAP_RAT | P97629 | Cystinyl Aminopeptidase, Rat | 20 | 0.33 | Binding ≤ 10μM |
| AMPL_HUMAN | P28838 | Leucine Aminopeptidase, Human | 220 | 0.28 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Antigen processing: Ubiquitination & Proteasome degradation | |
| Endosomal/Vacuolar pathway | |
| Metabolism of Angiotensinogen to Angiotensins | |
| Translocation of GLUT4 to the plasma membrane |
