Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.48 |
| ▸ | RARB | P10826 | 13/20 | 0.46 |
| ▸ | RARG | P13631 | 13/20 | 0.46 |
| ▸ | RARA | P10276 | 11/20 | 0.46 |
| ▸ | CYP26A1 | O43174 | 5/20 | 0.45 |
| ▸ | RXRA | P19793 | 7/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | GMNN | O75496 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | THPO | P40225 | 1/20 | 0.41 |
| ▸ | MTOR | P42345 | 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 | |
|---|---|---|---|---|
| SCHEMBL7746418 | 0.88 | RARB (0.57) | CYP3A4RARBRARGRARACYP26A1 | |
| SCHEMBL1615774 | 0.75 | RARB (0.72) | CYP3A4RARBRARGRARACYP26A1 | |
| SCHEMBL1615329 | 0.75 | RARB (0.72) | CYP3A4RARBRARGRARACYP26A1 | |
| SCHEMBL1615332 | 0.75 | RARB (0.72) | CYP3A4RARBRARGRARACYP26A1 | |
| SCHEMBL7751271 | 0.75 | RARB (0.72) | CYP3A4RARBRARGRARACYP26A1 | |
| SCHEMBL14785605 | 0.75 | RARB (0.56) | CYP3A4RARBRARGRARACYP26A1 | |
| SCHEMBL728001 | 0.74 | RARB (0.74) | CYP3A4RARBRARGRARACYP26A1 | |
| SCHEMBL2788640 | 0.73 | CYP3A4 (0.70) | CYP3A4RARBRARGRARACYP26A1 | |
| SCHEMBL17049073 | 0.73 | CYP3A4 (0.54) | CYP3A4RARBRARGRARACYP26A1 | |
| SCHEMBL9120878 | 0.73 | CYP3A4 (0.57) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6313162-B1 | FOR USE IN HUMAN OR VETERINARY MEDICINE SUCH AS DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR AND OPHHALMOLOGICAL DISORDERS; AND IN COSMETICS | CENTRE INTERNATIONAL DE RECHERCHE DERMATOLOGIQUES GALDERMA (C.I.R.D.) GALDERMA (FR) | 2001-11-06 | — | — | US | disclosed |
| US-6046220-A | ADMINISTERING TO THE PATIENT A PROPYNYL OR DIENYL BIAROMATIC COMPOUND TO TREAT A SKIN DISORDER, INFLAMMATORY CONDITIONS, VISION DEFECTS, ALOPECIA, CARDIOVASCULAR DISORDER, CANCER OR PRECANCER AND INSULIN DEPENDANT DIABETES | CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) | 2000-04-04 | — | — | US | disclosed |