Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | CCR8 | P51685 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | AHR | P35869 | 2/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.44 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.44 |
| ▸ | ITGAL | P20701 | 1/20 | 0.44 |
| ▸ | CA4 | P22748 | 1/20 | 0.44 |
| ▸ | CA6 | P23280 | 1/20 | 0.44 |
| ▸ | ADK | P55263 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10031 | 0.98 | ALDH1A1 (0.55) | ALDH1A1CCR8HSD17B10KMT2AAHR | |
| Hydrochloric Acid SCHEMBL3646722 | 0.95 | ALDH1A1 (0.53) | ALDH1A1CCR8HSD17B10KMT2AAHR | |
| Hydrochloric Acid SCHEMBL29744420 | 0.95 | ALDH1A1 (0.53) | ALDH1A1CCR8HSD17B10KMT2AAHR | |
| SCHEMBL20677769 | 0.95 | ALDH1A1 (0.53) | ALDH1A1CCR8HSD17B10KMT2AAHR | |
| Iodide SCHEMBL7508631 | 0.95 | ALDH1A1 (0.53) | ALDH1A1CCR8HSD17B10KMT2AAHR | |
| Benzene SCHEMBL28794130 | 0.95 | ALDH1A1 (0.53) | ALDH1A1CCR8HSD17B10KMT2AAHR | |
| Hydrochloric Acid SCHEMBL3397919 | 0.95 | ALDH1A1 (0.53) | ALDH1A1CCR8HSD17B10KMT2AAHR | |
| SCHEMBL6366012 | 0.95 | ALDH1A1 (0.53) | ALDH1A1CCR8HSD17B10KMT2AAHR | |
| SCHEMBL18900583 | 0.84 | FKBP5 (0.44) | ALDH1A1HSD17B10KMT2AAHRKDM4E | |
| Fumaric Acid SCHEMBL4611816 | 0.83 | HTR1A (0.47) | ALDH1A1HSD17B10KMT2AAHRKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008096917-A1 | REACTIVE ANTIBIOTICS AND ANTIBACTERIAL FIBER TREATED THEREBY | KOLON INDUSTRIES, INC (KR) | 2008-08-14 | — | — | WO | disclosed |