Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.51 |
| ▸ | RARB | P10826 | 5/20 | 0.48 |
| ▸ | RARG | P13631 | 5/20 | 0.48 |
| ▸ | RARA | P10276 | 4/20 | 0.48 |
| ▸ | CYP26A1 | O43174 | 6/20 | 0.47 |
| ▸ | RXRA | P19793 | 12/20 | 0.46 |
| ▸ | CYP26B1 | Q9NR63 | 3/20 | 0.46 |
| ▸ | RXRB | P28702 | 8/20 | 0.43 |
| ▸ | RXRG | P48443 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7801896 | 0.87 | RXRA (0.57) | CYP3A4RARBRARGRARACYP26A1 | |
| SCHEMBL2788640 | 0.81 | CYP3A4 (0.70) | CYP3A4RARBRARGRARACYP26A1 | |
| SCHEMBL6734636 | 0.77 | CYP3A4 (0.51) | CYP3A4RARBRARGRARACYP26A1 | |
| SCHEMBL7793997 | 0.76 | CYP26B1 (0.42) | CYP3A4RARBRARGRARACYP26A1 | |
| SCHEMBL7799679 | 0.76 | CYP26B1 (0.42) | CYP3A4RARBRARGRARACYP26A1 | |
| SCHEMBL6729936 | 0.76 | CYP3A4 (0.49) | CYP3A4RARBRARGRARACYP26A1 | |
| SCHEMBL7799675 | 0.76 | CYP26B1 (0.61) | CYP3A4RARBRARGRARACYP26A1 | |
| SCHEMBL7799676 | 0.76 | CYP26B1 (0.61) | CYP3A4RARBRARGRARACYP26A1 | |
| SCHEMBL8707418 | 0.75 | RXRA (0.72) | CYP3A4RARBRARGRARACYP26A1 | |
| SCHEMBL8708782 | 0.75 | RXRA (0.74) | CYP3A4RARBRARGRARACYP26A1 |
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 |