Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.42 |
| ▸ | RAPGEF4 | Q8WZA2 | 10/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL7467805 | 0.92 | CYP2A6 (0.47) | CYP1A2CYP2A6RAPGEF4NPC1MAPT | |
| SCHEMBL7914780 | 0.89 | CYP2A6 (0.50) | CYP1A2CYP2A6NPC1MAPTRAB9A | |
| SCHEMBL27633239 | 0.83 | CYP1A2 (0.48) | CYP1A2CYP2A6RAPGEF4NPC1MAPT | |
| SCHEMBL7456742 | 0.83 | CYP1A2 (0.33) | CYP1A2CYP2A6RAPGEF4NPC1MAPT | |
| SCHEMBL7909069 | 0.81 | CYP1A2 (0.39) | CYP1A2CYP2A6RAPGEF4NPC1MAPT | |
| SCHEMBL7465364 | 0.79 | CYP1A2 (0.40) | CYP1A2CYP2A6FFAR4ALDH1A1HPGD | |
| SCHEMBL20396010 | 0.79 | CYP1A2 (0.45) | CYP1A2CYP2A6NPC1MAPTRAB9A | |
| SCHEMBL7148799 | 0.79 | CYP1A2 (0.38) | CYP1A2CYP2A6RAPGEF4NPC1MAPT | |
| SCHEMBL7467096 | 0.78 | CYP1A2 (0.50) | CYP1A2CYP2A6RAPGEF4NPC1MAPT | |
| SCHEMBL18462944 | 0.78 | RAPGEF4 (0.45) | CYP1A2CYP2A6RAPGEF4ACHEALDH1A1 |
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-0775706-B1 | Borates photoinitiators from polyboranes | CIBA SC HOLDING AG (CH) | 2002-06-05 | — | — | EP | disclosed |
| EP-1203999-A2 | Photoinitiator comprising a borane and an electron donating compound | Ciba SC Holding AG (CH) | 2002-05-08 | — | — | EP | disclosed |
| US-6057078-A | PHOTOGRAPHY | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 2000-05-02 | — | — | US | disclosed |
| US-5807905-A | POLYMERIZATION OF UNSATURATED COMPOUNDS | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 1998-09-15 | — | — | US | disclosed |
| EP-0775706-A2 | Borates photoinitiators from polyboranes | Ciba SC Holding AG (CH) | 1997-05-28 | — | — | EP | disclosed |