Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | HSD17B2 | P37059 | 5/20 | 0.34 |
| ▸ | HSD17B1 | P14061 | 4/20 | 0.34 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | AR | P10275 | 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 | |
|---|---|---|---|---|
| SCHEMBL11058215 | 0.81 | HSD17B10 (0.42) | TSHRHSD17B10ESR2CA2CA1 | |
| SCHEMBL69521 | 0.78 | HSD17B10 (0.50) | TSHRHSD17B10ESR2CA2CA1 | |
| SCHEMBL15847756 | 0.78 | ALDH1A1 (0.40) | TSHRHSD17B10CA2CA1HSD17B2 | |
| SCHEMBL21728892 | 0.78 | CYP3A4 (0.39) | PTGS1PTGS2ALDH1A1 | |
| SCHEMBL11522267 | 0.78 | ESR1 (0.42) | HSD17B10ESR2ESR1HSD17B2HSD17B1 | |
| SCHEMBL11061171 | 0.76 | TSHR (0.37) | TSHRHSD17B10ESR2CA2CA1 | |
| SCHEMBL15847135 | 0.73 | MAPK1 (0.50) | TSHRHSD17B10CA2CA1HPGD | |
| SCHEMBL7940657 | 0.71 | ESR1 (0.39) | TSHRHSD17B10ESR2CA2CA1 | |
| SCHEMBL7651489 | 0.71 | LMNA (0.38) | TSHRCA2CA1HPGDALDH1A1 | |
| SCHEMBL17309716 | 0.69 | CYP3A4 (0.42) | TSHRHSD17B10ESR2CA2CA1 |
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-4164575-A | Combating pests with O-alkyl-O-trifluoromethylsulphinylphenyl-thiono(thiol)-phosphoric acid esters | BAYER AKTIENGESELLSCHAFT (DE) | 1979-08-14 | — | — | US | disclosed |