Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 16/20 | 0.66 |
| ▸ | RARA | P10276 | 14/20 | 0.66 |
| ▸ | RARG | P13631 | 13/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.66 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.49 |
| ▸ | CRABP2 | P29373 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL444860 | 0.91 | RARB (0.78) | RARBRARARARGCYP3A4KMT2A | |
| SCHEMBL9333830 | 0.88 | RARB (0.86) | RARBRARARARGCYP3A4KMT2A | |
| SCHEMBL9817784 | 0.87 | RARB (0.61) | RARBRARARARGCYP3A4KMT2A | |
| SCHEMBL9817836 | 0.87 | RARB (0.61) | RARBRARARARGCYP3A4KMT2A | |
| SCHEMBL9007043 | 0.84 | RARB (0.67) | RARBRARARARGCYP3A4KMT2A | |
| SCHEMBL9484975 | 0.84 | RARB (0.67) | RARBRARARARGCYP3A4KMT2A | |
| SCHEMBL9817808 | 0.84 | RARB (0.58) | RARBRARARARGCYP3A4KMT2A | |
| SCHEMBL9007075 | 0.83 | RARB (0.49) | RARBRARARARGCYP3A4KMT2A | |
| SCHEMBL7651593 | 0.82 | RARA (0.63) | RARBRARARARGCYP3A4KMT2A | |
| SCHEMBL9186679 | 0.82 | RARA (0.61) | RARBRARARARGCYP3A4KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0571546-B1 | CHROMAN AND THIOCHROMANS WITH PHENYLETHYNYL SUBSTITUENTS AT THE 7-POSITION HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY | ALLERGAN INC (US) | 1996-10-16 | — | — | EP | disclosed |
| US-5346915-A | Chromans and thiochromans with phenylethynyl substituents at the 7-position having retinold-like biological activity | ALLERGAN, INC. (US) | 1994-09-13 | — | — | US | disclosed |
| WO-1992014725-A1 | CHROMAN AND THIOCHROMANS WITH PHENYLETHYNYL SUBSTITUENTS AT THE 7-POSITION HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY | ALLERGAN, INC. (US) | 1992-09-03 | — | — | WO | disclosed |