Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.45 |
| ▸ | RXRA | P19793 | 4/20 | 0.40 |
| ▸ | RXRB | P28702 | 2/20 | 0.40 |
| ▸ | RXRG | P48443 | 2/20 | 0.40 |
| ▸ | CYP26A1 | O43174 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 5/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 4/20 | 0.35 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8099280 | 0.91 | RXRA (0.43) | CYP3A4RXRARXRBRXRGCYP26A1 | |
| SCHEMBL7802944 | 0.91 | RXRA (0.48) | CYP3A4RXRARXRBRXRGCYP26A1 | |
| SCHEMBL8101865 | 0.87 | CYP3A4 (0.54) | CYP3A4RXRARXRBRXRGCYP26A1 | |
| SCHEMBL7799981 | 0.82 | RXRA (0.51) | CYP3A4RXRARXRBRXRGCYP26A1 | |
| SCHEMBL8099423 | 0.81 | CYP3A4 (0.43) | CYP3A4RXRARXRBRXRGCYP26A1 | |
| SCHEMBL8093197 | 0.79 | CYP3A4 (0.54) | CYP3A4RXRARXRBRXRGCYP26A1 | |
| SCHEMBL7802940 | 0.77 | CYP26A1 (0.53) | CYP3A4RXRARXRBRXRGCYP26A1 | |
| SCHEMBL6733878 | 0.76 | CYP3A4 (0.71) | CYP3A4RXRARXRBRXRGCYP26A1 | |
| SCHEMBL8086450 | 0.71 | CYP3A4 (0.47) | CYP3A4RXRARXRBRXRGCYP26A1 | |
| SCHEMBL7801863 | 0.71 | RXRA (0.48) | CYP3A4RXRARXRBRXRGCYP26A1 |
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-6030952-A | AS HUMAN AND VETERINARY MEDICINE, PARTICULARLY IN THE TREATMENT OF DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR AND OPHTHALMOLOGIC CONDITIONS, AND IN COSMETIC COMPOSITIONS | CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIOUES GALDERMA (FR) | 2000-02-29 | — | — | US | disclosed |