Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 9/20 | 0.67 |
| ▸ | MMP2 | P08253 | 3/20 | 0.45 |
| ▸ | MMP9 | P14780 | 3/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | MMP7 | P09237 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7185942 | 1.00 | MMP13 (0.67) | MMP13MMP2MMP9CASP1MAPK1 | |
| SCHEMBL7185980 | 0.90 | MMP13 (0.82) | MMP13CASP1CA2 | |
| SCHEMBL7185986 | 0.90 | MMP13 (0.82) | MMP13CASP1CA2 | |
| SCHEMBL31488862 | 0.77 | ALDH1A1 (0.51) | CASP1MAPK1ALDH1A1CYP3A4 | |
| SCHEMBL7183687 | 0.77 | MMP13 (0.79) | MMP13MMP2ALDH1A1MMP1MMP3 | |
| SCHEMBL8976911 | 0.77 | CTSL (0.55) | ALDH1A1 | |
| SCHEMBL7183683 | 0.77 | MMP13 (0.79) | MMP13MMP2ALDH1A1MMP1MMP3 | |
| SCHEMBL330061 | 0.77 | CTSL (0.55) | ALDH1A1 | |
| SCHEMBL31265234 | 0.77 | CASP1 (0.54) | CASP1MAPK1ALDH1A1 | |
| SCHEMBL5486969 | 0.77 | CTSL (0.55) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6583299-B1 | Matrix metalloprotease inhibitors; nonsuppression of tumor necrosis factor production | G.D. SEARLE & CO. | 2003-06-24 | — | — | US | disclosed |