Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 9/20 | 0.49 |
| ▸ | RARG | P13631 | 9/20 | 0.49 |
| ▸ | RARA | P10276 | 7/20 | 0.49 |
| ▸ | HSPA9 | P38646 | 4/20 | 0.45 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | RXRA | P19793 | 3/20 | 0.34 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.31 |
| ▸ | GMNN | O75496 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9056886 | 0.87 | RARB (0.49) | RARBRARGRARAHSPA9AR | |
| SCHEMBL26721193 | 0.81 | RARB (0.54) | RARBRARGRARARXRAALDH1A1 | |
| SCHEMBL18741109 | 0.76 | RARB (0.40) | RARBRARGRARACYP2A6RXRA | |
| SCHEMBL3714772 | 0.76 | RARB (0.50) | RARBRARGRARAHSPA9AR | |
| SCHEMBL30298339 | 0.76 | RARB (0.40) | RARBRARGRARACYP2A6RXRA | |
| SCHEMBL3838099 | 0.75 | RARB (0.57) | RARBRARGRARARXRAALDH1A1 | |
| SCHEMBL1396642 | 0.75 | RARB (0.49) | RARBRARGRARAHSPA9AR | |
| SCHEMBL19859121 | 0.75 | RARB (0.49) | RARBRARGRARAHSPA9AR | |
| SCHEMBL9057990 | 0.75 | RARB (0.49) | RARBRARGRARAHSPA9AR | |
| SCHEMBL6325616 | 0.75 | RARB (0.49) | RARBRARGRARAHSPA9AR |
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 |