Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP1 | P53582 | 9/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.37 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 5/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL8874748 | 1.00 | METAP1 (0.45) | METAP1NPC1ALDH1A1PLA2G1BNFKB1 | |
| SCHEMBL8874477 | 0.86 | METAP1 (0.40) | METAP1NPC1ALDH1A1PLA2G1BNFKB1 | |
| SCHEMBL8597894 | 0.86 | METAP1 (0.40) | METAP1NPC1ALDH1A1PLA2G1BNFKB1 | |
| SCHEMBL8597895 | 0.86 | METAP1 (0.40) | METAP1NPC1ALDH1A1PLA2G1BNFKB1 | |
| SCHEMBL8875167 | 0.81 | METAP1 (0.67) | METAP1ACHE | |
| SCHEMBL8598137 | 0.81 | METAP1 (0.67) | METAP1ACHE | |
| SCHEMBL8873297 | 0.78 | METAP1 (0.46) | METAP1NPC1ALDH1A1RAB9AL3MBTL1 | |
| SCHEMBL8601005 | 0.78 | METAP1 (0.46) | METAP1NPC1ALDH1A1RAB9AL3MBTL1 | |
| SCHEMBL8600959 | 0.78 | METAP1 (0.50) | METAP1L3MBTL1CYP19A1ACHE | |
| SCHEMBL8598468 | 0.78 | METAP1 (0.50) | METAP1ACHE |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0657426-B1 | Tricyclic pyrrole derivatives | HOFFMANN LA ROCHE (CH) | 1998-07-22 | — | — | EP | disclosed |
| US-5646173-A | ANTISEROTONINE AGENTS; CENTRAL NERVOUS SYSTEM DISORDERS; ANTIDEPRESSANTS | HOFFMANN-LA ROCHE INC. (US) | 1997-07-08 | — | — | US | disclosed |
| EP-0657426-A2 | Tricyclic pyrrole derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1995-06-14 | — | — | EP | disclosed |