Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A1 | O15245 | 3/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.65 |
| ▸ | TP53 | P04637 | 1/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.65 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.65 |
| ▸ | TSHR | P16473 | 1/20 | 0.65 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.65 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.65 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.63 |
| ▸ | DNM1 | Q05193 | 5/20 | 0.59 |
| ▸ | LSS | P48449 | 1/20 | 0.50 |
| ▸ | APAF1 | O14727 | 1/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.50 |
| ▸ | RAD52 | P43351 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Tetrapentylammonium SCHEMBL10909204 | 0.97 | SLC22A1 (0.67) | SLC22A1ALDH1A1TP53CYP3A4ALOX15 | |
| Tetrabuthylammonium SCHEMBL757473 | 0.92 | SLC22A1 (0.67) | SLC22A1ALDH1A1TP53CYP3A4ALOX15 | |
| Water SCHEMBL590034 | 0.86 | SLC22A1 (0.93) | SLC22A1ALDH1A1TP53CYP3A4ALOX15 | |
| Tetrahexylammonium SCHEMBL11425180 | 0.84 | SLC22A1 (0.68) | SLC22A1ALDH1A1TP53CYP3A4ALOX15 | |
| Tetrahexylammonium SCHEMBL28553561 | 0.84 | SLC22A1 (0.68) | SLC22A1ALDH1A1TP53CYP3A4ALOX15 | |
| Tetrahexylammonium SCHEMBL11425178 | 0.84 | SLC22A1 (0.68) | SLC22A1ALDH1A1TP53CYP3A4ALOX15 | |
| Cyanamide SCHEMBL4581489 | 0.84 | SLC22A1 (0.68) | SLC22A1ALDH1A1TP53CYP3A4ALOX15 | |
| Tetrahexylammonium SCHEMBL28552746 | 0.84 | ALDH1A1 (0.74) | SLC22A1ALDH1A1TP53CYP3A4ALOX15 | |
| Tetrahexylammonium SCHEMBL27855393 | 0.83 | SLC22A1 (0.87) | SLC22A1ALDH1A1TP53CYP3A4ALOX15 | |
| SCHEMBL17238751 | 0.83 | SLC22A1 (0.87) | SLC22A1ALDH1A1TP53CYP3A4ALOX15 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4602080-A | POLYISOCYANURATES | SOCIETE CARBOCHIMIQUE EN ABREGE "CARBOCHIM" (BE) | 1986-07-22 | — | — | US | claimed |
| US-4544743-A | Salts of 1,3,5-oxadiazines-2,4,6-triones, 1,3,5-oxadiazines-2,4,6-triones and the preparation thereof | SOCIETE CARBOCHIMIQUE (BE) | 1985-10-01 | — | — | US | claimed |
| US-4602080-A | POLYISOCYANURATES | SOCIETE CARBOCHIMIQUE EN ABREGE "CARBOCHIM" (BE) | 1986-07-22 | — | — | US | disclosed |
| US-4544743-A | Salts of 1,3,5-oxadiazines-2,4,6-triones, 1,3,5-oxadiazines-2,4,6-triones and the preparation thereof | SOCIETE CARBOCHIMIQUE (BE) | 1985-10-01 | — | — | US | disclosed |