Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FKBP1A | P62942 | 3/20 | 0.59 |
| ▸ | POLB | P06746 | 2/20 | 0.55 |
| ▸ | ITGB1 | P05556 | 4/20 | 0.55 |
| ▸ | ITGA4 | P13612 | 4/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | PKM | P14618 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | F2 | P00734 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL11250683 | 1.00 | FKBP1A (0.59) | FKBP1APOLBITGB1ITGA4ALDH1A1 | |
| SCHEMBL11250707 | 1.00 | FKBP1A (0.59) | FKBP1APOLBITGB1ITGA4ALDH1A1 | |
| Bromide SCHEMBL11247303 | 0.99 | FKBP1A (0.58) | FKBP1APOLBITGB1ITGA4ALDH1A1 | |
| Bromide SCHEMBL11247292 | 0.99 | FKBP1A (0.58) | FKBP1APOLBITGB1ITGA4ALDH1A1 | |
| Bromide SCHEMBL11247297 | 0.99 | FKBP1A (0.58) | FKBP1APOLBITGB1ITGA4ALDH1A1 | |
| SCHEMBL9139680 | 0.86 | ITGB1 (0.61) | FKBP1APOLBITGB1ITGA4ALDH1A1 | |
| SCHEMBL11248906 | 0.86 | FKBP1A (0.57) | FKBP1APOLBITGB1ITGA4ALDH1A1 | |
| SCHEMBL11248915 | 0.86 | FKBP1A (0.57) | FKBP1APOLBITGB1ITGA4ALDH1A1 | |
| SCHEMBL11248907 | 0.86 | FKBP1A (0.57) | FKBP1APOLBITGB1ITGA4ALDH1A1 | |
| SCHEMBL6352517 | 0.84 | ITGB1 (0.55) | FKBP1APOLBITGB1ITGA4ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0019411-B1 | 1-PHENYL-2-AMINOETHANOL DERIVATIVES, PROCESSES FOR THEIR MANUFACTURE AND PHARMACEUTICAL COMPOSITIONS THEREOF | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1982-12-22 | — | — | EP | disclosed |
| US-4323575-A | TOPICAL ANTIINFLAMMATORY AGENTS | IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) | 1982-04-06 | — | — | US | disclosed |
| EP-0019411-A1 | 1-Phenyl-2-aminoethanol derivatives, processes for their manufacture and pharmaceutical compositions thereof | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1980-11-26 | — | — | EP | disclosed |