Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | FDPS | P14324 | 1/20 | 0.39 |
| ▸ | ACP3 | P15309 | 4/20 | 0.37 |
| ▸ | KIF11 | P52732 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL4274915 | 0.71 | SRC (0.38) | ACP3CES2CES1CYP2D6 | |
| SCHEMBL4533278 | 0.69 | CYP2C9 (0.54) | CYP1A2CYP2C9CYP2C19FDPSKIF11 | |
| SCHEMBL4274555 | 0.69 | SRC (0.39) | ACP3CES2CES1CYP2D6 | |
| SCHEMBL28837273 | 0.69 | SRC (0.39) | ACP3CES2CES1CYP2D6 | |
| SCHEMBL11860744 | 0.68 | CYP1A2 (0.58) | CYP1A2CYP2C9CYP2C19FDPSKIF11 | |
| SCHEMBL4284038 | 0.67 | SRC (0.34) | ACP3CES2CES1CYP2D6 | |
| SCHEMBL4279202 | 0.67 | SRC (0.34) | ACP3TAAR1CES2CES1CYP2D6 | |
| SCHEMBL27277756 | 0.66 | CYP1A2 (0.56) | CYP1A2CYP2C9CYP2C19FDPSKIF11 | |
| SCHEMBL7666090 | 0.66 | SLC6A2 (0.58) | CYP1A2CYP2C9CYP2C19FDPSSMN1; SMN2 | |
| SCHEMBL5968241 | 0.66 | CYP1A2 (0.56) | CYP1A2CYP2C9CYP2C19FDPSKIF11 |
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-0970964-B1 | Method for producing a titanium complex | SUMITOMO CHEMICAL CO (JP) | 2004-04-21 | — | — | EP | disclosed |
| US-6090961-A | Method for producing titanium complex | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2000-07-18 | — | — | US | disclosed |
| EP-0970964-A2 | Method for producing titanium complex | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2000-01-12 | — | — | EP | disclosed |