Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | CA3 | P07451 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Phenol SCHEMBL27566674 | 0.87 | TDP1 (0.48) | ALDH1A1CA12CA1CA2GLA | |
| Methacrylic Acid SCHEMBL4631005 | 0.87 | ALDH1A1 (0.39) | ALDH1A1KDM4ETDP1PKMMAPK1 | |
| Methacrylic Acid SCHEMBL2913483 | 0.87 | ALDH1A1 (0.39) | ALDH1A1KDM4ETDP1PKMMAPK1 | |
| Phenol SCHEMBL1224881 | 0.84 | CA12 (0.55) | ALDH1A1CA12CA1CA2GLA | |
| Phenol SCHEMBL174433 | 0.84 | CA12 (0.55) | ALDH1A1KDM4ECA12CA1CA2 | |
| Phenol SCHEMBL184346 | 0.84 | CA12 (0.55) | ALDH1A1KDM4ECA12CA1CA2 | |
| Phenol SCHEMBL9052733 | 0.84 | CA12 (0.55) | ALDH1A1KDM4ECA12CA1CA2 | |
| Phenol SCHEMBL1738526 | 0.84 | CA12 (0.55) | ALDH1A1CA12CA1CA2GLA | |
| Phenol SCHEMBL1199743 | 0.84 | CA12 (0.55) | ALDH1A1KDM4ECA12CA1CA2 | |
| Phenol SCHEMBL165006 | 0.84 | CA12 (0.55) | ALDH1A1KDM4ECA12CA1CA2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2000079312-A1 | HIGH REFRACTIVE INDEX COMPOSITIONS FOR OPHTHALMIC IMPLANTS | BAUSCH & LOMB SURGICAL, INC. (US) | 2000-12-28 | — | — | WO | claimed |
| US-20040198880-A1 | Floor polish composition | JOHNSONDIVERSEY, INC. | 2004-10-07 | — | — | US | disclosed |
| WO-2000079312-A1 | HIGH REFRACTIVE INDEX COMPOSITIONS FOR OPHTHALMIC IMPLANTS | BAUSCH & LOMB SURGICAL, INC. (US) | 2000-12-28 | — | — | WO | disclosed |