Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ALPI | P09923 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | XIAP | P98170 | 1/20 | 0.39 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8050764 | 0.74 | TRPA1 (0.47) | CYP1A2EPHX1ALPIPKMPTGS1 | |
| SCHEMBL5609280 | 0.74 | CPA1 (0.46) | CYP1A2EPHX1ALPIPKMPTGS1 | |
| SCHEMBL10514103 | 0.72 | EPHX1 (0.52) | CYP1A2EPHX1ALPIPKMPTGS1 | |
| SCHEMBL1287175 | 0.70 | EPHX1 (0.50) | CYP1A2EPHX1ALPIPKMPTGS1 | |
| SCHEMBL7897856 | 0.70 | CYP1A2 (0.45) | CYP1A2EPHX1ALPIPKMPTGS1 | |
| SCHEMBL11741416 | 0.69 | EPHX1 (0.55) | CYP1A2EPHX1ALPIPKMPTGS1 | |
| SCHEMBL1833632 | 0.69 | EPHX1 (0.55) | CYP1A2EPHX1ALPIPKMPTGS1 | |
| SCHEMBL11327689 | 0.69 | CYP2D6 (0.42) | MAPK1CYP1A2TAAR1CYP2C19CYP2D6 | |
| SCHEMBL8864309 | 0.67 | NPSR1 (0.42) | KDM4ELMNAMAPK1CYP1A2EPHX1 | |
| SCHEMBL4274915 | 0.67 | SRC (0.38) | LMNAMAPK1CYP2D6 |
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 |