Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.48 |
| ▸ | THRB | P10828 | 3/20 | 0.48 |
| ▸ | CA3 | P07451 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | CA6 | P23280 | 1/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 3/20 | 0.44 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | CA9 | Q16790 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | RECQL | P46063 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11441247 | 0.77 | MEN1 (0.50) | ALDH1A1CYP3A4ALOX15HIF1ACA14 | |
| SCHEMBL10857974 | 0.72 | ALDH1A1 (0.48) | ALDH1A1CYP3A4ALOX15CA14THRB | |
| SCHEMBL10339603 | 0.71 | TYR (0.54) | ALDH1A1CYP3A4ALOX15HIF1ACA14 | |
| SCHEMBL11447692 | 0.69 | ALDH1A1 (0.39) | ALDH1A1CYP3A4ALOX15HIF1ATHRB | |
| Hydroquinone SCHEMBL28468106 | 0.67 | CA2 (0.80) | ALDH1A1CYP3A4ALOX15HIF1ACA14 | |
| Hydroquinone SCHEMBL6012111 | 0.67 | CA12 (0.80) | ALDH1A1CYP3A4ALOX15HIF1ACA14 | |
| SCHEMBL1146723 | 0.67 | ESR2 (0.53) | ALDH1A1CYP3A4ALOX15HIF1ACA14 | |
| Hydroquinone SCHEMBL460669 | 0.67 | ALOX15 (1.00) | ALDH1A1CYP3A4ALOX15HIF1ACA14 | |
| Hydroquinone SCHEMBL15516 | 0.67 | — | — | |
| Hydroquinone SCHEMBL11511669 | 0.67 | ALOX15 (1.00) | ALDH1A1CYP3A4ALOX15HIF1ACA14 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4540692-A | Anti-inflammatory N-(1-oxo-2,4,6-cycloheptatrienyl)2H-1,2-benzothiazine-3-carboxamide 1,1-dioxide derivatives, compositions, and method of use | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1985-09-10 | — | — | US | disclosed |
| EP-0126894-A1 | Tropone derivatives, processes for preparation thereof and pharmaceutical composition comprising the same | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1984-12-05 | — | — | EP | disclosed |