Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.65 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.65 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.53 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.53 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.51 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | CDC25B | P30305 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | PRNP | P04156 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL16949829 | 0.89 | GABRA1 (0.67) | KMT2ACYP3A4CYP2C9GABRA1GABRB2 | |
| SCHEMBL39623 | 0.87 | HMGB1 (0.65) | KMT2ACYP3A4CYP2C9GABRA1GABRB2 | |
| SCHEMBL29695710 | 0.87 | HMGB1 (0.65) | KMT2ACYP3A4CYP2C9GABRA1GABRB2 | |
| Bicarbonate SCHEMBL237485 | 0.85 | HMGB1 (0.62) | KMT2ACYP3A4CYP2C9GABRA1GABRB2 | |
| Hydrochloric Acid SCHEMBL11527302 | 0.85 | HMGB1 (0.62) | KMT2ACYP3A4CYP2C9GABRA1GABRB2 | |
| SCHEMBL3953764 | 0.85 | ALDH1A1 (0.56) | KMT2ACYP3A4CYP2C9CLCN2ALDH1A1 | |
| SCHEMBL27360496 | 0.85 | HMGB1 (0.62) | KMT2ACYP3A4CYP2C9GABRA1GABRB2 | |
| SCHEMBL11525711 | 0.84 | GABRA1 (0.55) | KMT2ACYP3A4CYP2C9GABRA1GABRB2 | |
| SCHEMBL28351438 | 0.84 | ALDH1A1 (0.54) | KMT2ACYP3A4CYP2C9CLCN2ALDH1A1 | |
| Phthalic Acid SCHEMBL3256652 | 0.80 | CLCN2 (0.56) | KMT2ACYP3A4CYP2C9GABRA1GABRB2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017093835-A1 | WATER-SOLUBLE UV-ABSORBING COMPOUNDS AND USES THEREOF | NOVARTIS AG (CH) | 2017-06-08 | — | — | WO | disclosed |