| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 28th, 2010 | 25 | No |
Popular Name: DNC009957 DNC009957
| 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) | 3.40 | 6.04 | -21.28 | 2 | 5 | 0 | 83 | 353.399 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.40 | 7.25 | -65.07 | 1 | 5 | -1 | 86 | 352.391 | 4 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| MMP12-1-E | Macrophage Metalloelastase (cluster #1 Of 2), Eukaryotic | Eukaryotes | 590 | 0.35 | Binding ≤ 10μM |
| MMP13-4-E | Matrix Metalloproteinase 13 (cluster #4 Of 4), Eukaryotic | Eukaryotes | 1400 | 0.33 | Binding ≤ 10μM |
| MMP14-2-E | Matrix Metalloproteinase 14 (cluster #2 Of 3), Eukaryotic | Eukaryotes | 8300 | 0.28 | Binding ≤ 10μM |
| MMP16-1-E | Matrix Metalloproteinase 16 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 5100 | 0.30 | Binding ≤ 10μM |
| MMP2-1-E | 72 KDa Type IV Collagenase (cluster #1 Of 3), Eukaryotic | Eukaryotes | 1300 | 0.33 | Binding ≤ 10μM |
| MMP8-4-E | Matrix Metalloproteinase 8 (cluster #4 Of 4), Eukaryotic | Eukaryotes | 1000 | 0.34 | Binding ≤ 10μM |
| MMP9-1-E | Matrix Metalloproteinase 9 (cluster #1 Of 3), Eukaryotic | Eukaryotes | 7700 | 0.29 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| MMP12_HUMAN | P39900 | Matrix Metalloproteinase 12, Human | 590 | 0.35 | Binding ≤ 1μM |
| MMP8_HUMAN | P22894 | Matrix Metalloproteinase 8, Human | 1000 | 0.34 | Binding ≤ 1μM |
| MMP12_HUMAN | P39900 | Matrix Metalloproteinase 12, Human | 590 | 0.35 | Binding ≤ 10μM |
| MMP13_HUMAN | P45452 | Matrix Metalloproteinase 13, Human | 1400 | 0.33 | Binding ≤ 10μM |
| MMP14_HUMAN | P50281 | Matrix Metalloproteinase 14, Human | 8300 | 0.28 | Binding ≤ 10μM |
| MMP16_HUMAN | P51512 | Matrix Metalloproteinase 16, Human | 5100 | 0.30 | Binding ≤ 10μM |
| MMP8_HUMAN | P22894 | Matrix Metalloproteinase 8, Human | 1000 | 0.34 | Binding ≤ 10μM |
| MMP9_HUMAN | P14780 | Matrix Metalloproteinase 9, Human | 7700 | 0.29 | Binding ≤ 10μM |
| MMP2_HUMAN | P08253 | Matrix Metalloproteinase-2, Human | 1300 | 0.33 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Activation of Matrix Metalloproteinases | |
| Assembly of collagen fibrils and other multimeric structures | |
| Collagen degradation | |
| Degradation of the extracellular matrix | |
| EPH-ephrin mediated repulsion of cells | |
| Regulation of Insulin-like Growth Factor (IGF) transport and uptake by Insulin-l | |
| Signaling by SCF-KIT |
