Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 1/20 | 0.53 |
| ▸ | MMP3 | P08254 | 1/20 | 0.53 |
| ▸ | MMP9 | P14780 | 1/20 | 0.53 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.48 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.47 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.47 |
| ▸ | CTSC | P53634 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | CTSS | P25774 | 2/20 | 0.46 |
| ▸ | CTSL | P07711 | 1/20 | 0.46 |
| ▸ | CTSB | P07858 | 1/20 | 0.46 |
| ▸ | CTSK | P43235 | 1/20 | 0.46 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.44 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9813890 | 0.86 | POLB (0.57) | MMP1MMP3MMP9MAPTTDP1 | |
| SCHEMBL30064554 | 0.86 | MMP1 (0.51) | MMP1MMP3MMP9OPRK1ITGA4 | |
| SCHEMBL31293776 | 0.85 | OPRD1 (0.55) | MMP1MMP3MMP9OPRK1ITGA4 | |
| SCHEMBL1755615 | 0.84 | TDP1 (0.61) | MMP1MMP3MMP9MAPTTDP1 | |
| SCHEMBL29651398 | 0.83 | GNPAT (0.56) | HDAC3HDAC4HDAC1HDAC2HDAC8 | |
| SCHEMBL29484050 | 0.83 | MMP1 (0.55) | MMP1MMP3MMP9OPRK1ITGA4 | |
| SCHEMBL464256 | 0.83 | MMP1 (0.53) | MMP1MMP3MMP9HDAC3HDAC4 | |
| SCHEMBL22722647 | 0.83 | OPRK1 (0.53) | MMP1MMP3MMP9OPRK1HDAC3 | |
| SCHEMBL30197545 | 0.83 | MMP1 (0.53) | MMP1MMP3MMP9OPRK1ITGA4 | |
| SCHEMBL24833948 | 0.83 | CTSC (0.51) | MMP1MMP3MMP9OPRK1CTSC |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022265577-A2 | CORONAVIRUS ENZYME MODULATORS, METHODS OF SYNTHESIS AND USES THEREOF | AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) | 2022-12-22 | — | — | WO | disclosed |