Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPA1 | P15085 | 2/20 | 0.44 |
| ▸ | CPB1 | P15086 | 1/20 | 0.44 |
| ▸ | CPA3 | P15088 | 1/20 | 0.44 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.44 |
| ▸ | MIF | P14174 | 1/20 | 0.39 |
| ▸ | MMP12 | P39900 | 3/20 | 0.38 |
| ▸ | MMP9 | P14780 | 2/20 | 0.37 |
| ▸ | MMP13 | P45452 | 2/20 | 0.37 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | MMEL1 | Q495T6 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP14 | P50281 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 5/20 | 0.36 |
| ▸ | PPARA | Q07869 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7301211 | 0.88 | MME (0.41) | MMP9MMP2FOLH1 | |
| SCHEMBL7309324 | 0.81 | ACE (0.36) | MMP12MMP13MMP8MMP2ALDH1A1 | |
| SCHEMBL7297423 | 0.77 | CPA1 (0.51) | CPA1CPB1CPA3CPB2MIF | |
| SCHEMBL7308314 | 0.74 | CPA1 (0.58) | CPA1CPB1CPA3CPB2MIF | |
| SCHEMBL7302912 | 0.72 | CPA1 (0.51) | CPA1CPB1CPA3CPB2MIF | |
| SCHEMBL7313252 | 0.70 | CPA1 (0.40) | CPA1CPB1CPA3CPB2MIF | |
| SCHEMBL11828675 | 0.70 | MMP12 (0.50) | CPA1CPB1CPA3CPB2MMP12 | |
| SCHEMBL7310081 | 0.70 | CPA1 (0.49) | CPA1CPB1CPA3CPB2MIF | |
| SCHEMBL27462683 | 0.69 | PPARG (0.53) | CPA1CPB1CPA3CPB2HDAC6 | |
| SCHEMBL8588593 | 0.69 | FDPS (0.41) | MMP12MMP13MMP8NPC1RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0780386-B1 | Matrix metalloprotease inhibitors | HOFFMANN LA ROCHE (CH) | 2002-10-02 | — | — | EP | disclosed |
| EP-0780386-A1 | Matrix metalloprotease inhibitors | F. HOFFMANN-LA ROCHE AG (CH) | 1997-06-25 | — | — | EP | disclosed |