Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL7051304 | 0.85 | HTR6 (0.36) | CYP1A2CYP2A6 | |
| SCHEMBL6332120 | 0.71 | CYP1A2 (0.44) | CYP1A2CYP2A6 | |
| SCHEMBL7054455 | 0.68 | CYP1A2 (0.34) | CYP1A2CYP2A6 | |
| SCHEMBL7053084 | 0.68 | CYP1A2 (0.34) | CYP1A2CYP2A6NPC1RAB9A | |
| SCHEMBL7048708 | 0.67 | CYP1A2 (0.33) | CYP1A2CYP2A6 | |
| SCHEMBL7051332 | 0.67 | CYP1A2 (0.33) | CYP1A2CYP2A6 | |
| SCHEMBL7053639 | 0.66 | CYP1A2 (0.32) | CYP1A2CYP2A6 | |
| SCHEMBL7048568 | 0.66 | KDM1A (0.39) | CYP2A6 | |
| SCHEMBL25795852 | 0.65 | CYP2A6 (0.48) | CYP1A2CYP2A6NPC1RAB9A | |
| SCHEMBL7056298 | 0.65 | CYP1A2 (0.31) | CYP1A2CYP2A6 |
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-0985674-B1 | ORGANIC COMPOUNDS CONTAINING SILICON OR GERMANIUM, TRANSITION METAL COMPLEXES, CATALYST FOR ALPHA-OLEFIN POLYMERIZATION, AND PROCESSES FOR PRODUCING ALPHA-OLEFIN POLYMERS | MITSUBISHI CHEM CORP (JP) | 2003-04-23 | — | — | EP | disclosed |
| US-6255515-B1 | COORDINATION POLYMERIZATION CATALYSTS | MITSUBISHI CHEMICAL CORPORATION (JP) | 2001-07-03 | — | — | US | disclosed |
| EP-0985674-A1 | ORGANIC COMPOUNDS CONTAINING SILICON OR GERMANIUM, TRANSITION METAL COMPLEXES, CATALYST FOR $g(a)-OLEFIN POLYMERIZATION, AND PROCESSES FOR PRODUCING $g(a)-OLEFIN POLYMERS | MITSUBISHI CHEMICAL CORPORATION (JP) | 2000-03-15 | — | — | EP | disclosed |