Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 3/20 | 0.59 |
| ▸ | MAPT | P10636 | 8/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.52 |
| ▸ | RELA | Q04206 | 1/20 | 0.52 |
| ▸ | ITGB3 | P05106 | 5/20 | 0.47 |
| ▸ | ITGA2B | P08514 | 5/20 | 0.47 |
| ▸ | LMNA | P02545 | 5/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | BRD4 | O60885 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.43 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19086177 | 0.87 | PNMT (0.58) | PNMTMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL8555210 | 0.81 | ITGB3 (0.73) | PNMTMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL978035 | 0.81 | PNMT (0.56) | PNMTMAPTALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL28533972 | 0.77 | PNMT (0.70) | PNMTMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL6421837 | 0.75 | PNMT (1.00) | PNMTALDH1A1ITGB3ITGA2BTPSAB1 | |
| SCHEMBL17076814 | 0.74 | F2 (0.65) | ITGB3ITGA2BLMNAMEN1KMT2A | |
| SCHEMBL17076662 | 0.74 | MELK (0.65) | ITGB3ITGA2BLMNAMEN1KMT2A | |
| SCHEMBL977949 | 0.73 | PNMT (0.73) | PNMTALDH1A1ITGB3ITGA2BLMNA | |
| Hydrochloric Acid SCHEMBL3441470 | 0.72 | PNMT (0.71) | PNMTALDH1A1ITGB3ITGA2BLMNA | |
| SCHEMBL6425786 | 0.72 | PNMT (0.70) | PNMTMAPTALDH1A1NPC1RAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2197552-B1 | NOVEL TETRAHYDROFUSEDPYRIDINES AS HISTONE DEACETYLASE INHIBITORS | 4SC AG (DE) | 2012-11-21 | — | — | EP | disclosed |