Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B3 | P37058 | 7/20 | 0.70 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.65 |
| ▸ | GLA | P06280 | 3/20 | 0.65 |
| ▸ | GAA | P10253 | 3/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.65 |
| ▸ | HPGD | P15428 | 2/20 | 0.65 |
| ▸ | CASP1 | P29466 | 2/20 | 0.65 |
| ▸ | CASP7 | P55210 | 2/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.65 |
| ▸ | ERAP1 | Q9NZ08 | 2/20 | 0.65 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.65 |
| ▸ | TSHR | P16473 | 1/20 | 0.65 |
| ▸ | NQO1 | P15559 | 1/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.55 |
| ▸ | ESR1 | P03372 | 2/20 | 0.55 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL10794069 | 0.88 | HSD17B3 (0.55) | HSD17B3KDM4EGLAGAAALDH1A1 | |
| SCHEMBL3761517 | 0.85 | HSD17B3 (0.78) | HSD17B3KDM4EGLAGAAALDH1A1 | |
| SCHEMBL29725796 | 0.85 | HSD17B3 (0.78) | HSD17B3KDM4EGLAGAAALDH1A1 | |
| SCHEMBL12204766 | 0.84 | HSD17B3 (0.64) | HSD17B3KDM4EGLAGAAALDH1A1 | |
| SCHEMBL10650322 | 0.83 | KDM4E (0.70) | HSD17B3KDM4EGLAGAAALDH1A1 | |
| Ocimarin SCHEMBL23752453 | 0.82 | HSD17B3 (0.79) | HSD17B3KDM4EGLAGAAALDH1A1 | |
| SCHEMBL11097084 | 0.82 | HSD17B3 (0.89) | HSD17B3KDM4EGLAGAAALDH1A1 | |
| SCHEMBL3767036 | 0.82 | HSD17B3 (1.00) | HSD17B3KDM4EGLAGAAALDH1A1 | |
| SCHEMBL13823667 | 0.81 | HSD17B3 (0.68) | HSD17B3KDM4EGLAGAAALDH1A1 | |
| SCHEMBL29785070 | 0.81 | KDM4E (0.76) | HSD17B3KDM4EGLAGAAALDH1A1 |
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-0111746-B1 | SULFONIC-ACID ESTERS OF HYDROXYCOUMARINES, THEIR PREPARATION AND MEDICINES CONTAINING THEM | BASF Aktiengesellschaft (DE) | 1987-09-16 | — | — | EP | disclosed |
| US-4618622-A | ANTIDEPRESSANTS, ANTIALLERGENS | BASF AKTIENGESELLSCHAFT (DE) | 1986-10-21 | — | — | US | disclosed |
| EP-0111746-A2 | Sulfonic-acid esters of hydroxycoumarines, their preparation and medicines containing them | BASF Aktiengesellschaft (DE) | 1984-06-27 | — | — | EP | disclosed |