Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.60 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.59 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.49 |
| ▸ | CCR6 | P51684 | 1/20 | 0.46 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | CKS1B | P61024 | 1/20 | 0.45 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | THRA | P10827 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2173758 | 0.88 | CYP4A11 (0.75) | CYP4A11CYP4F2LOXL2CCR6HKDC1 | |
| SCHEMBL2162519 | 0.88 | CYP4A11 (0.72) | CYP4A11CYP4F2LOXL2CCR6HKDC1 | |
| SCHEMBL9762683 | 0.86 | CA12 (0.47) | CYP4A11CYP4F2MAPTALDH1A1TP53 | |
| SCHEMBL18106036 | 0.85 | CYP4A11 (0.79) | CYP4A11CYP4F2LOXL2CCR6HKDC1 | |
| SCHEMBL9763014 | 0.85 | ALDH1A1 (0.51) | MAPTALDH1A1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL19580918 | 0.84 | CYP4A11 (0.61) | CYP4A11CYP4F2LOXL2CCR6HKDC1 | |
| SCHEMBL12354618 | 0.84 | CYP4A11 (0.65) | CYP4A11CYP4F2LOXL2MAPTALDH1A1 | |
| SCHEMBL18106009 | 0.84 | CYP4A11 (0.74) | CYP4A11CYP4F2LOXL2CCR6HKDC1 | |
| SCHEMBL9763639 | 0.83 | RARB (0.50) | CYP4A11CYP4F2MAPTALDH1A1TP53 | |
| SCHEMBL9763633 | 0.82 | SPHK1 (0.44) | ALDH1A1THRATHRBSPHK1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4990505-A | Treating asthma, bronchitis; adrenergic stimulants | GLAXO GROUP LIMITED (GB) | 1991-02-05 | — | — | US | disclosed |
| US-4853381-A | Ethanolamine compounds | GLAXO GROUP LIMITED (GB) | 1989-08-01 | — | — | US | disclosed |
| EP-0223410-A2 | Ethanolamine Derivatives | GLAXO GROUP LIMITED (GB) | 1987-05-27 | — | — | EP | disclosed |