Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SSTR3 | P32745 | 1/20 | 0.58 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.55 |
| ▸ | CCKBR | P32239 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.51 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.51 |
| ▸ | PDE5A | O76074 | 3/20 | 0.49 |
| ▸ | DHODH | Q02127 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7519979 | 0.90 | CYP2D6 (0.67) | HDAC1HDAC6CCKBRMEN1KMT2A | |
| SCHEMBL13568945 | 0.84 | CYP2D6 (0.78) | SSTR3HDAC1HDAC6CCKBRMEN1 | |
| SCHEMBL18254530 | 0.84 | CYP2D6 (0.78) | SSTR3HDAC1HDAC6CCKBRMEN1 | |
| SCHEMBL1921430 | 0.84 | CYP2D6 (0.78) | SSTR3HDAC1HDAC6CCKBRMEN1 | |
| SCHEMBL12967991 | 0.81 | CCKBR (0.82) | SSTR3HDAC1HDAC6CCKBRMEN1 | |
| SCHEMBL16489369 | 0.81 | CCKBR (0.82) | SSTR3HDAC1HDAC6CCKBRMEN1 | |
| SCHEMBL12967653 | 0.81 | CCKBR (0.82) | SSTR3HDAC1HDAC6CCKBRMEN1 | |
| SCHEMBL1922130 | 0.81 | CCKBR (0.82) | SSTR3HDAC1HDAC6CCKBRMEN1 | |
| SCHEMBL1921747 | 0.81 | CCKBR (0.82) | SSTR3HDAC1HDAC6CCKBRMEN1 | |
| SCHEMBL7525817 | 0.80 | KDM4E (0.62) | CCKBRMEN1KMT2AALDH1A1ALOX12 |
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-0891187-B1 | USE OF DERIVATIVES OF TETRAHYDRO-BETA-CARBOLINES AS ANTIMETASTATIC AGENTS | HOFFMANN LA ROCHE (CH) | 2002-01-30 | — | — | EP | claimed |