Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 5/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.50 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.48 |
| ▸ | PPARG | P37231 | 7/20 | 0.48 |
| ▸ | PPARD | Q03181 | 7/20 | 0.48 |
| ▸ | PPARA | Q07869 | 7/20 | 0.48 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.48 |
| ▸ | TLR2 | O60603 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | FABP4 | P15090 | 2/20 | 0.48 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.48 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.48 |
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Butyl Alcohol SCHEMBL10596987 | 0.97 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 | |
| Dodecanol SCHEMBL23364909 | 0.89 | TSHR (0.68) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 | |
| Docosanol SCHEMBL28822935 | 0.89 | TSHR (0.68) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 | |
| Propionic Acid SCHEMBL29199038 | 0.88 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 | |
| Propionic Acid SCHEMBL107943 | 0.88 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 | |
| Hexane SCHEMBL5595400 | 0.88 | AKR1B1 (0.63) | ALDH1A1SMN1; SMN2TSHRHSD17B10MEN1 | |
| Butyl Alcohol SCHEMBL30712613 | 0.88 | ALDH1A1 (0.73) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 | |
| Butyl Alcohol SCHEMBL793489 | 0.88 | ALDH1A1 (0.73) | ALDH1A1SMN1; SMN2TSHRLMNAHSD17B10 | |
| Hexane SCHEMBL28927850 | 0.88 | AKR1B1 (0.63) | ALDH1A1SMN1; SMN2TSHRHSD17B10MEN1 | |
| Butyl Alcohol SCHEMBL27387947 | 0.88 | — | — |
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-4151102-A | POLYISOBUTYLENE, ESTER OF ALPHA-HYDROXY ACID, UNSATURATED ACID | SWISS ALUMINIUM LTD. (CH) | 1979-04-24 | — | — | US | disclosed |