Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.42 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.41 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SPHK2 | Q9NRA0 | 3/20 | 0.39 |
| ▸ | SPHK1 | Q9NYA1 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8671443 | 1.00 | ALDH1A1 (0.62) | ALDH1A1TDP1SMN1; SMN2CYP1A2EPHX1 | |
| SCHEMBL8676128 | 1.00 | ALDH1A1 (0.62) | ALDH1A1TDP1SMN1; SMN2CYP1A2EPHX1 | |
| SCHEMBL8672600 | 0.98 | ALDH1A1 (0.64) | ALDH1A1TDP1SMN1; SMN2CYP1A2EPHX1 | |
| Butylcyclohexane SCHEMBL28147520 | 0.93 | CYP1A2 (0.62) | ALDH1A1TDP1SMN1; SMN2CYP1A2EPHX1 | |
| Benzene SCHEMBL9283052 | 0.87 | ALDH1A1 (0.62) | ALDH1A1TDP1SMN1; SMN2EPHX1TSHR | |
| SCHEMBL28495305 | 0.85 | TSHR (0.64) | ALDH1A1TDP1SMN1; SMN2CYP1A2EPHX1 | |
| SCHEMBL27508747 | 0.85 | TSHR (0.64) | ALDH1A1TDP1SMN1; SMN2CYP1A2EPHX1 | |
| SCHEMBL27489352 | 0.85 | TSHR (0.64) | ALDH1A1TDP1SMN1; SMN2CYP1A2EPHX1 | |
| SCHEMBL9716217 | 0.85 | TSHR (0.64) | ALDH1A1TDP1SMN1; SMN2CYP1A2EPHX1 | |
| SCHEMBL27487263 | 0.83 | TSHR (0.67) | ALDH1A1TDP1SMN1; SMN2EPHX1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5801202-A | Amine derivatives for treatment of skin disorders | KAO COPRORATION (JP) | 1998-09-01 | — | — | US | disclosed |
| EP-0790977-A1 | AMINE DERIVATIVES FOR TREATMENT OF SKIN DISORDERS | Kao Corporation (JP) | 1997-08-27 | — | — | EP | disclosed |
| WO-1996015098-A1 | AMINE DERIVATIVES FOR TREATMENT OF SKIN DISORDERS | KAO CORPORATION (JP) | 1996-05-23 | — | — | WO | disclosed |