Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.43 |
| ▸ | CXCR1 | P25024 | 4/20 | 0.43 |
| ▸ | CXCR2 | P25025 | 4/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 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 |
| ▸ | RARB | P10826 | 1/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 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 | |
|---|---|---|---|---|
| SCHEMBL6454165 | 0.80 | CXCR1 (0.49) | ALDH1A1PTGS2CXCR1CXCR2CA12 | |
| SCHEMBL10154287 | 0.79 | KMT2A (0.49) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL18249745 | 0.78 | TMEM97 (0.52) | ALDH1A1PTGS2CA1CA2CHRM1 | |
| SCHEMBL5321195 | 0.78 | TAAR1 (0.52) | ALDH1A1CA12CA1CA2CA4 | |
| SCHEMBL6457789 | 0.78 | RECQL (0.58) | ALDH1A1PTGS2CXCR1CXCR2CA12 | |
| SCHEMBL1275321 | 0.78 | RECQL (0.58) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL10154041 | 0.78 | TAAR1 (0.52) | ALDH1A1CA12CA1CA2CA4 | |
| SCHEMBL6793104 | 0.77 | IDO1 (0.59) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL6454513 | 0.77 | MMP8 (0.45) | ALDH1A1PTGS2CXCR1CXCR2CA12 | |
| SCHEMBL6458675 | 0.76 | ALDH1A1 (0.49) | ALDH1A1PTGS2CXCR1CXCR2CA12 |
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 |