Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | YAP1 | P46937 | 1/20 | 0.43 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.43 |
| ▸ | TEAD2 | Q15562 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 2/20 | 0.42 |
| ▸ | MMP9 | P14780 | 2/20 | 0.42 |
| ▸ | MMP14 | P50281 | 2/20 | 0.42 |
| ▸ | MMP7 | P09237 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CXCR1 | P25024 | 4/20 | 0.40 |
| ▸ | CXCR2 | P25025 | 4/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.40 |
| ▸ | ALB | P02768 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5272433 | 0.83 | ALDH1A1 (0.47) | ALDH1A1CXCR1CXCR2PTGS2PTGS1 | |
| SCHEMBL22864844 | 0.81 | PPARG (0.47) | ALDH1A1MMP2MMP9MMP14MMP7 | |
| SCHEMBL576200 | 0.80 | MMP2 (0.55) | YAP1TEAD4TEAD2MMP2MMP9 | |
| SCHEMBL22623364 | 0.80 | ALDH1A1 (0.45) | ALDH1A1CXCR1CXCR2PTGS2PTGS1 | |
| SCHEMBL5272436 | 0.80 | ALDH1A1 (0.45) | ALDH1A1CA2CA12CXCR1CXCR2 | |
| SCHEMBL22864845 | 0.80 | ALDH1A1 (0.45) | ALDH1A1CXCR1CXCR2PTGS2PTGS1 | |
| SCHEMBL5273133 | 0.80 | ALDH1A1 (0.45) | ALDH1A1CXCR1CXCR2PTGS2PTGS1 | |
| SCHEMBL28509968 | 0.79 | YAP1 (0.48) | ALDH1A1YAP1TEAD4TEAD2MMP2 | |
| SCHEMBL7694473 | 0.78 | YAP1 (0.43) | YAP1TEAD4TEAD2MMP2MMP9 | |
| SCHEMBL4535172 | 0.77 | CXCR2 (0.48) | ALDH1A1CXCR1CXCR2PTGS2PTGS1 |
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-1606248-A2 | SULFONIC ACIDS, THEIR DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | Dompé S.P.A. (IT) | 2005-12-21 | — | — | EP | disclosed |
| WO-2004080951-A2 | SULFONIC ACIDS, THEIR DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | DOMPE S.P.A. (IT) | 2004-09-23 | — | — | WO | disclosed |