Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 3/20 | 0.42 |
| ▸ | ESR1 | P03372 | 5/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.41 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.38 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7902094 | 0.89 | TYR (0.56) | TYRESR1ESR2HTTMAPT | |
| SCHEMBL7909295 | 0.85 | HSD17B1 (0.51) | TYRESR1ESR2HSD17B3HTT | |
| SCHEMBL3084044 | 0.81 | HSD17B1 (0.57) | TYRESR1ESR2HSD17B3HTT | |
| SCHEMBL22114060 | 0.80 | LMNA (0.40) | HTTMAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL10658033 | 0.79 | CES2 (0.50) | TYRESR1ESR2HSD17B3HTT | |
| SCHEMBL10454859 | 0.79 | PTPN1 (0.47) | TYRESR1ESR2HSD17B3HTT | |
| Acetic Acid SCHEMBL6129825 | 0.79 | PTPN1 (0.51) | HSD17B3HTTMAPTALOX5TSHR | |
| SCHEMBL9745 | 0.78 | PTPN1 (0.54) | TYRHSD17B3HTTMAPTALOX5 | |
| SCHEMBL27252511 | 0.77 | PPARG (0.36) | TYRHTTTSHRHSP90AB1 | |
| SCHEMBL1081179 | 0.76 | GABRA1 (0.42) | ESR1ESR2MAPTMEN1ALOX5 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6211328-B1 | IN PRESENCE OF AN ACID | GUN EI CHEMICAL INDUSTRY CO., LTD (JP) | 2001-04-03 | — | — | US | disclosed |