Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 8/20 | 0.61 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.52 |
| ▸ | CA4 | P22748 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA7 | P43166 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | NQO1 | P15559 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 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 SCHEMBL8679262 | 0.96 | CYP2A6 (0.67) | CYP2A6ALOX12CYP1A2CA4CA1 | |
| Naphthalene SCHEMBL51883 | 0.83 | CYP2A6 (0.89) | CYP2A6ALOX12CYP1A2CA1CA2 | |
| Naphthalene SCHEMBL29782159 | 0.83 | CYP2A6 (0.89) | CYP2A6ALOX12CYP1A2CA1CA2 | |
| Naphthalene SCHEMBL9850341 | 0.83 | CYP2A6 (0.89) | CYP2A6ALOX12CYP1A2CA1CA2 | |
| Naphthalene SCHEMBL15378952 | 0.83 | CYP2A6 (0.89) | CYP2A6ALOX12CYP1A2CA1CA2 | |
| Naphthalene SCHEMBL1451946 | 0.79 | CYP2A6 (0.80) | CYP2A6ALOX12CYP1A2CA1CA2 | |
| Naphthalene SCHEMBL30216954 | 0.79 | CYP2A6 (0.80) | CYP2A6ALOX12CYP1A2CA1CA2 | |
| Naphthalene SCHEMBL16289671 | 0.79 | CYP2A6 (0.80) | CYP2A6ALOX12CYP1A2CA1CA2 | |
| Naphthalene SCHEMBL1331142 | 0.78 | CYP2A6 (1.00) | CYP2A6ALOX12CYP1A2CA1CA2 | |
| Naphthalene SCHEMBL1332240 | 0.78 | CYP2A6 (1.00) | CYP2A6ALOX12CYP1A2CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20100057052-A1 | Medical Catheter Tube | KANEKA CORPORATION (JP) | 2010-03-04 | — | — | US | disclosed |