Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL115842 | 0.87 | CYP3A4 (0.39) | CYP3A4TDP1TAAR1SLC6A2 | |
| SCHEMBL29514487 | 0.85 | CYP3A4 (0.38) | CYP3A4TDP1TAAR1SLC6A2 | |
| SCHEMBL28791530 | 0.81 | CYP3A4 (0.35) | CYP3A4TDP1TAAR1SLC6A2 | |
| Hydrochloric Acid SCHEMBL9810632 | 0.81 | CYP3A4 (0.35) | CYP3A4TDP1TAAR1SLC6A2 | |
| SCHEMBL23843916 | 0.79 | CYP3A4 (0.33) | CYP3A4TDP1TAAR1SLC6A2 | |
| SCHEMBL8966352 | 0.78 | CYP3A4 (0.39) | CYP3A4TDP1TAAR1SLC6A2 | |
| SCHEMBL7049252 | 0.78 | CYP3A4 (0.39) | CYP3A4TDP1TAAR1SLC6A2 | |
| SCHEMBL662184 | 0.78 | CYP3A4 (0.39) | CYP3A4TDP1TAAR1SLC6A2 | |
| SCHEMBL3804292 | 0.78 | KCNN4 (0.32) | CYP3A4TDP1 | |
| SCHEMBL9249942 | 0.78 | CYP3A4 (0.32) | CYP3A4TDP1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0300583-B1 | Process for the preparation of polymers | SHELL INT RESEARCH (NL) | 1993-12-08 | — | — | EP | disclosed |
| US-4994592-A | Polymerization process | SHELL OIL COMPANY (US) | 1991-02-19 | — | — | US | disclosed |
| US-4935396-A | Polymerization process | SHELL OIL COMPANY (US) | 1990-06-19 | — | — | US | disclosed |
| US-4880900-A | Carbon monoxide/olefin polymerization process with bis (diaryl phosphino) 2-silapropane containing catalyst | SHELL OIL COMPANY (US) | 1989-11-14 | — | — | US | disclosed |
| EP-0300583-A2 | Process for the preparation of polymers | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1989-01-25 | — | — | EP | disclosed |