Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 6/20 | 0.57 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | JAK1 | P23458 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Naphthalene SCHEMBL8512071 | 1.00 | CYP2A6 (0.57) | CYP2A6ALOX12ALDH1A1TSHRRELA | |
| Naphthalene SCHEMBL56790 | 0.96 | CYP2A6 (0.61) | CYP2A6ALOX12ALDH1A1TSHRRELA | |
| Anthracene SCHEMBL5068227 | 0.83 | CYP2A6 (0.44) | CYP2A6ALOX12ALDH1A1TSHRRELA | |
| Naphthalene SCHEMBL9856642 | 0.82 | ALDH1A1 (0.50) | CYP2A6ALOX12ALDH1A1TSHRHSD17B10 | |
| Naphthalene SCHEMBL1518058 | 0.80 | CYP2A6 (0.89) | CYP2A6ALOX12ALDH1A1TSHRRELA | |
| SCHEMBL29352674 | 0.80 | CYP2A6 (0.89) | CYP2A6ALOX12ALDH1A1TSHRRELA | |
| SCHEMBL6806439 | 0.80 | CYP2A6 (0.89) | CYP2A6ALOX12ALDH1A1TSHRRELA | |
| Naphthalene SCHEMBL30984504 | 0.80 | CYP2A6 (0.89) | CYP2A6ALOX12ALDH1A1TSHRRELA | |
| Naphthalene SCHEMBL10706759 | 0.79 | CYP2A6 (0.57) | CYP2A6ALOX12ALDH1A1TSHRRELA | |
| Biphenyl SCHEMBL322601 | 0.79 | ALDH1A1 (0.64) | CYP2A6ALDH1A1TSHRRELAHSD17B10 |
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-1999038924-A1 | COATING COMPOSITION | SOLA INTERNATIONAL HOLDINGS LTD. (AU) | 1999-08-05 | — | — | WO | claimed |