Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | PTP4A3 | O75365 | 1/20 | 0.32 |
| ▸ | PTP4A1 | Q93096 | 1/20 | 0.32 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.31 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.31 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.30 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.30 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.30 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10999487 | 0.86 | CYP3A4 (0.39) | CYP3A4HSD17B10ALDH1A1TSHRPTP4A3 | |
| SCHEMBL10928922 | 0.77 | ESR1 (0.46) | CYP3A4SERPINE1AKR1C4AKR1C3AKR1C2 | |
| SCHEMBL10885203 | 0.73 | CYP3A4 (0.36) | CYP3A4HSD17B10ALDH1A1TSHRPTP4A3 | |
| SCHEMBL9451830 | 0.71 | ALDH1A1 (0.39) | CYP3A4HSD17B10ALDH1A1TSHRPTP4A3 | |
| SCHEMBL10930754 | 0.71 | HSD17B10 (0.39) | HSD17B10TSHRPTPN2KMT2A | |
| SCHEMBL4973652 | 0.70 | CYP3A4 (0.49) | CYP3A4HSD17B10ALDH1A1TSHRPTP4A3 | |
| SCHEMBL10906862 | 0.70 | CYP3A4 (0.61) | CYP3A4HSD17B10ALDH1A1TSHRPTP4A3 | |
| SCHEMBL7173526 | 0.70 | CYP3A4 (0.57) | CYP3A4HSD17B10ALDH1A1TSHRPTP4A3 | |
| SCHEMBL11056615 | 0.69 | HSD17B10 (0.34) | CYP3A4HSD17B10ALDH1A1PTP4A3PTP4A1 | |
| SCHEMBL10887119 | 0.68 | THRB (0.40) | CYP3A4ALDH1A1TSHRPTP4A3PTP4A1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-60136541-A | — | — | None | — | — | JP | disclosed |
| JP-S60136541-A | ALLYL SALICYLATE DERIVATIVE | NIPPON KOGAKU KK <NIKON> | 1985-07-20 | — | — | JP | disclosed |