Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.32 |
| ▸ | MAP2K7 | O14733 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | CDC25A | P30304 | 1/20 | 0.32 |
| ▸ | CDC25B | P30305 | 1/20 | 0.32 |
| ▸ | PRNP | P04156 | 1/20 | 0.32 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11173637 | 0.80 | ALDH1A1 (0.36) | ALDH1A1HSD17B10LMNAKDM4ETP53 | |
| SCHEMBL11852699 | 0.79 | — | — | |
| SCHEMBL8608903 | 0.76 | ALDH1A1 (0.39) | ALDH1A1HSD17B10LMNAKDM4ETP53 | |
| SCHEMBL9266439 | 0.76 | ALDH1A1 (0.39) | ALDH1A1HSD17B10LMNAKDM4ETP53 | |
| SCHEMBL9258089 | 0.76 | ALDH1A1 (0.39) | ALDH1A1HSD17B10LMNAKDM4ETP53 | |
| SCHEMBL17297262 | 0.75 | TP53 (0.33) | ALDH1A1TP53MAPTPTGS1 | |
| SCHEMBL9520079 | 0.70 | ALDH1A1 (0.39) | ALDH1A1HSD17B10LMNAKDM4ETP53 | |
| SCHEMBL15346472 | 0.69 | GABRR1 (0.38) | TP53 | |
| SCHEMBL6985043 | 0.69 | ALDH1A1 (0.35) | ALDH1A1HSD17B10LMNAKDM4ETP53 | |
| SCHEMBL25659030 | 0.69 | ALDH1A1 (0.33) | ALDH1A1HSD17B10TP53MAPTPTGS1 |
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-4028408-A | Novel preparation of trifluoromethylthioacetic acid | SMITHKLINE CORPORATION (US) | 1977-06-07 | — | — | US | claimed |
| US-4028408-A | Novel preparation of trifluoromethylthioacetic acid | SMITHKLINE CORPORATION (US) | 1977-06-07 | — | — | US | disclosed |