Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 7/20 | 0.38 |
| ▸ | RARG | P13631 | 7/20 | 0.38 |
| ▸ | RARA | P10276 | 5/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.33 |
| ▸ | CRABP2 | P29373 | 1/20 | 0.32 |
| ▸ | CLK1 | P49759 | 1/20 | 0.32 |
| ▸ | CLK2 | P49760 | 1/20 | 0.32 |
| ▸ | CLK3 | P49761 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
| ▸ | MELK | Q14680 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9273777 | 0.89 | RARB (0.36) | RARBRARGRARACYP3A4CYP26A1 | |
| SCHEMBL4370171 | 0.79 | ALK (0.39) | RARBRARGRARACYP3A4CYP26A1 | |
| SCHEMBL9328615 | 0.76 | RARA (0.35) | RARBRARGRARACYP3A4CYP26A1 | |
| SCHEMBL8558172 | 0.75 | RARB (0.40) | RARBRARGRARACYP3A4CYP26A1 | |
| SCHEMBL4373673 | 0.75 | RARB (0.58) | RARBRARGRARACYP3A4CYP26A1 | |
| SCHEMBL5737805 | 0.75 | RARB (0.35) | RARBRARGRARACYP3A4CYP26A1 | |
| SCHEMBL9024103 | 0.74 | KDM4E (0.38) | RARBRARGRARACYP3A4CYP26A1 | |
| SCHEMBL8629043 | 0.74 | RARB (0.50) | RARBRARGRARAGABRA1GABRG2 | |
| SCHEMBL995907 | 0.74 | CYP3A4 (0.70) | RARBRARGRARACYP3A4CYP26A1 | |
| SCHEMBL9024091 | 0.73 | GABRA1 (0.34) | GABRA1GABRG2GABRB3GABRA5GABRA3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0738267-A1 | ACETYLENES DISUBSTITUTED WITH A PHENYL OR HETEROARYL GROUP AND A 2-OXOCHROMANYL, 2-OXOTHIOCHROMANYL OR 2-OXO-1,2,3,4-TETRAHYDROQUINOLINYL GROUP HAVING RETINOID-LIKE ACTIVITY | Allergan (US) | 1996-10-23 | — | — | EP | disclosed |
| US-5399561-A | Used for treating skin disorders in mammals | ALLERGAN, INC. (US) | 1995-03-21 | — | — | US | disclosed |