Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 4/20 | 0.57 |
| ▸ | ACHE | P22303 | 3/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 3/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | METAP1 | P53582 | 1/20 | 0.38 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8873354 | 1.00 | CYP19A1 (0.57) | CYP19A1ACHEKDM4ELMNAPOLB | |
| SCHEMBL8595332 | 1.00 | CYP19A1 (0.57) | CYP19A1ACHEKDM4ELMNAPOLB | |
| SCHEMBL8873437 | 0.86 | CYP19A1 (0.60) | CYP19A1ACHEKDM4ELMNAPOLB | |
| SCHEMBL8597901 | 0.86 | CYP19A1 (0.60) | CYP19A1ACHEKDM4ELMNAPOLB | |
| SCHEMBL8874770 | 0.83 | ACHE (0.54) | CYP19A1ACHEHTR2CHTR2AHTR2B | |
| SCHEMBL8595671 | 0.83 | ACHE (0.54) | CYP19A1ACHEHTR2CHTR2AHTR2B | |
| SCHEMBL8595669 | 0.83 | ACHE (0.54) | CYP19A1ACHEHTR2CHTR2AHTR2B | |
| SCHEMBL8597617 | 0.82 | METAP1 (0.39) | CYP19A1ACHEMETAP1AADAT | |
| SCHEMBL8597615 | 0.82 | METAP1 (0.39) | CYP19A1ACHEMETAP1AADAT | |
| SCHEMBL8873801 | 0.82 | METAP1 (0.39) | CYP19A1ACHEMETAP1AADAT |
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 |