Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F10 | P00742 | 1/20 | 0.36 |
| ▸ | ACKR3 | P25106 | 6/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
| ▸ | KLKB1 | P03952 | 3/20 | 0.34 |
| ▸ | APP | P05067 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3577929 | 0.73 | SLC6A7 (0.41) | F10KLKB1ALDH1A1LMNAHTT | |
| SCHEMBL14160624 | 0.68 | TDP1 (0.41) | ALDH1A1LMNAHTTHTR2A | |
| SCHEMBL3577425 | 0.64 | MAPK1 (0.43) | ALDH1A1LMNAHTT | |
| SCHEMBL411705 | 0.61 | BCL2L1 (0.62) | APPCYP3A4CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL3585870 | 0.61 | SLC6A7 (0.76) | ALDH1A1 | |
| SCHEMBL18503388 | 0.61 | MEN1 (0.47) | CYP2D6ALDH1A1 | |
| SCHEMBL30747689 | 0.60 | MAOB (0.55) | APPCYP3A4CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL10436026 | 0.60 | MAOB (0.55) | APPCYP3A4CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL18924450 | 0.58 | MAPK14 (0.58) | ALDH1A1 | |
| SCHEMBL18503386 | 0.58 | MEN1 (0.47) | CYP2D6ALDH1A1LMNAHTT |
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-1893212-B1 | MULTICYCLIC COMPOUNDS AND METHODS OF THEIR USE | LEXICON PHARMACEUTICALS INC (US) | 2013-10-16 | — | — | EP | disclosed |