Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 9/20 | 0.38 |
| ▸ | RARG | P13631 | 9/20 | 0.38 |
| ▸ | RARA | P10276 | 8/20 | 0.38 |
| ▸ | HSPA9 | P38646 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 3/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.34 |
| ▸ | GMNN | O75496 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9052965 | 0.87 | RARB (0.46) | RARBRARGRARAHSPA9ALDH1A1 | |
| SCHEMBL7217368 | 0.76 | RARA (0.38) | RARBRARGRARAHSPA9ALDH1A1 | |
| SCHEMBL9053795 | 0.75 | MEN1 (0.46) | RARBRARGRARAHSPA9KDM4E | |
| SCHEMBL7717570 | 0.74 | RARB (0.46) | RARBRARGRARAALDH1A1TSHR | |
| SCHEMBL9054067 | 0.74 | RARA (0.38) | RARBRARGRARAHSPA9ALDH1A1 | |
| SCHEMBL9055225 | 0.74 | RARA (0.38) | RARBRARGRARAHSPA9ALDH1A1 | |
| SCHEMBL9053340 | 0.73 | CA2 (0.47) | RARBRARGRARAALDH1A1RXRA | |
| SCHEMBL3838099 | 0.72 | RARB (0.57) | RARBRARGRARAALDH1A1RXRA | |
| SCHEMBL9055499 | 0.71 | CA1 (0.53) | RARBRARGRARAALDH1A1CYP26A1 | |
| SCHEMBL9295885 | 0.71 | RARA (0.35) | RARBRARGRARAHSPA9CYP26A1 |
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-5498755-A | IMINE COMPOUNDS FOR SKIN DISORDERS AND ANTIINFLAMMATORY AGENTS | ALLERGAN, INC. | 1996-03-12 | — | — | US | disclosed |
| WO-1996006070-A1 | DISUBSTITUTED ARYL AND HETEROARYL IMINES HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY | ALLERGAN (US) | 1996-02-29 | — | — | WO | disclosed |