Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | LOX | P28300 | 1/20 | 0.35 |
| ▸ | LOXL3 | P58215 | 1/20 | 0.35 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL11870679 | 0.88 | TSHR (0.41) | TSHRALDH1A1TDP1LOXLOXL3 | |
| SCHEMBL7846196 | 0.87 | — | — | |
| SCHEMBL8653772 | 0.84 | TSHR (0.46) | TSHRALDH1A1TDP1 | |
| SCHEMBL11908474 | 0.84 | ALDH1A1 (0.41) | TSHRALDH1A1TDP1LOXLOXL3 | |
| SCHEMBL11859365 | 0.84 | ALDH1A1 (0.41) | TSHRALDH1A1TDP1LOXLOXL3 | |
| SCHEMBL24688765 | 0.83 | — | — | |
| SCHEMBL2711997 | 0.83 | TSHR (0.38) | TSHRALDH1A1TDP1 | |
| SCHEMBL1009215 | 0.83 | — | — | |
| SCHEMBL17935751 | 0.83 | TSHR (0.38) | TSHRALDH1A1TDP1 | |
| SCHEMBL2711995 | 0.83 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0686613-B1 | OZONIDE REDUCING AGENT | OTSUKA KAGAKU KK (JP) | 2001-11-14 | — | — | EP | disclosed |
| US-5770729-A | SULFIDE COMPOUND WITH POLAR SUBSTITUENTS, FORMATION OF SULFOXIDE, MILD CONDITIONS, SAFE, NONPOLLUTING | OTSUKA KAGAKU KABUSHIKI KAISHA (JP) | 1998-06-23 | — | — | US | disclosed |
| EP-0686613-A1 | OZONIDE REDUCING AGENT | OTSUKA KAGAKU KABUSHIKI KAISHA (JP) | 1995-12-13 | — | — | EP | disclosed |
| US-3985673-A | BY INCORPORATING AN ORGANIC PHOSPHITE | PHILLIPS PETROLEUM COMPANY (US) | 1976-10-12 | — | — | US | disclosed |