Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP1 | P53582 | 5/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | S100A4 | P26447 | 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 | |
|---|---|---|---|---|
| SCHEMBL8874155 | 1.00 | METAP1 (0.41) | METAP1CYP19A1ACHEAADATNOTUM | |
| SCHEMBL5951282 | 0.86 | CYP19A1 (0.38) | METAP1CYP19A1ACHEAADATNOTUM | |
| SCHEMBL9431937 | 0.85 | CYP19A1 (0.41) | METAP1CYP19A1NOTUMMAPT | |
| SCHEMBL8597615 | 0.84 | METAP1 (0.39) | METAP1CYP19A1ACHEAADATNOTUM | |
| SCHEMBL8873801 | 0.84 | METAP1 (0.39) | METAP1CYP19A1ACHEAADATNOTUM | |
| SCHEMBL8597617 | 0.84 | METAP1 (0.39) | METAP1CYP19A1ACHEAADATNOTUM | |
| SCHEMBL8598439 | 0.81 | ACHE (0.57) | METAP1CYP19A1ACHEAADATALDH1A1 | |
| SCHEMBL8873660 | 0.81 | ACHE (0.57) | METAP1CYP19A1ACHEAADATALDH1A1 | |
| SCHEMBL5952774 | 0.81 | METAP1 (0.43) | METAP1CYP19A1ACHEAADATNOTUM | |
| SCHEMBL8873437 | 0.79 | CYP19A1 (0.60) | METAP1CYP19A1ACHEAADATMAPT |
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 |