Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.50 |
| ▸ | CYP26A1 | O43174 | 5/20 | 0.50 |
| ▸ | RARB | P10826 | 12/20 | 0.49 |
| ▸ | RARG | P13631 | 12/20 | 0.49 |
| ▸ | RARA | P10276 | 10/20 | 0.49 |
| ▸ | CRABP2 | P29373 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | RXRA | P19793 | 5/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | GMNN | O75496 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL180442 | 0.85 | CYP3A4 (0.70) | CYP3A4CYP26A1RARBRARGRARA | |
| SCHEMBL6665791 | 0.84 | RARB (0.46) | CYP3A4CYP26A1RARBRARGRARA | |
| SCHEMBL9484730 | 0.84 | RARB (0.62) | CYP3A4CYP26A1RARBRARGRARA | |
| SCHEMBL19342919 | 0.81 | CYP3A4 (0.49) | CYP3A4CYP26A1RARBRARGRARA | |
| SCHEMBL9271106 | 0.80 | RARB (0.49) | CYP3A4CYP26A1RARBRARGRARA | |
| SCHEMBL8865723 | 0.79 | CYP3A4 (0.42) | CYP3A4CYP26A1RARBRARGRARA | |
| SCHEMBL5084210 | 0.79 | CYP3A4 (0.72) | CYP3A4CYP26A1RARBRARGRARA | |
| SCHEMBL9264079 | 0.79 | CYP26A1 (0.54) | CYP3A4CYP26A1RARBRARGRARA | |
| SCHEMBL22198810 | 0.78 | RARB (0.51) | CYP3A4CYP26A1RARBRARGRARA | |
| SCHEMBL9268548 | 0.76 | RARB (0.46) | CYP3A4CYP26A1RARBRARGRARA |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5466690-A | Treating psoriasis | ALLERGAN, INC. (US) | 1995-11-14 | — | — | US | disclosed |
| US-5354776-A | Treating psoriasis | ALLERGAN, INC. (US) | 1994-10-11 | — | — | US | disclosed |
| EP-0284261-B1 | Acetylenes disubstituted with a heteroaromatic group and a tetralin group having retinoid like activity | ALLERGAN INC (US) | 1994-01-05 | — | — | EP | disclosed |
| US-5246962-A | Psoriasis, skin disorders | ALLERGAN, INC. (US) | 1993-09-21 | — | — | US | disclosed |
| US-5149705-A | Treatment of psoriasis | ALLERGAN, INC. (US) | 1992-09-22 | — | — | US | disclosed |
| EP-0284261-A1 | Acetylenes disubstituted with a heteroaromatic group and a tetralin group having retinoid like activity | ALLERGAN, INC (US) | 1988-09-28 | — | — | EP | disclosed |