Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | HPGD | P15428 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL16575424 | 0.76 | NQO1 (0.46) | NQO1KDM4EADORA3ALDH1A1HPGD | |
| SCHEMBL18071781 | 0.76 | NQO1 (0.46) | NQO1KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL6630377 | 0.73 | NQO1 (0.48) | NQO1KDM4EADORA3ALDH1A1HPGD | |
| SCHEMBL29292635 | 0.71 | AOC3 (0.41) | NQO1KDM4EALDH1A1MAPTAOC3 | |
| SCHEMBL9169536 | 0.71 | NQO1 (0.41) | NQO1KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL4570827 | 0.71 | NQO1 (0.50) | NQO1KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL29292637 | 0.69 | CD274 (0.40) | KDM4EALDH1A1MAPTTP53MEN1 | |
| SCHEMBL19885259 | 0.69 | NQO1 (0.48) | NQO1KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL7692656 | 0.68 | NQO1 (0.54) | NQO1KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL1911836 | 0.68 | NQO1 (0.54) | NQO1KDM4EALDH1A1HPGDMAPT |
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-0565488-B1 | Fluorine free titanocenes and their application | CIBA GEIGY AG (CH) | 1999-04-21 | — | — | EP | disclosed |
| US-5340701-A | Photoinitiators | CIBA-GEIGY CORPORATION (US) | 1994-08-23 | — | — | US | disclosed |
| EP-0565488-A1 | Fluorine free titanocenes and their application | CIBA-GEIGY AG (CH) | 1993-10-13 | — | — | EP | disclosed |