Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.54 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.52 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CKS1B | P61024 | 1/20 | 0.40 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | IDH1 | O75874 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9088289 | 0.89 | CYP4A11 (0.41) | CYP4A11CYP4F2CA1CA2CA12 | |
| SCHEMBL9087966 | 0.89 | CA12 (0.41) | CYP4A11CYP4F2ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL9086571 | 0.85 | CYP4A11 (0.42) | CYP4A11CYP4F2ALDH1A1HRH1MAPT | |
| SCHEMBL27319129 | 0.83 | ALDH1A1 (0.41) | CYP4A11CYP4F2ALDH1A1HSD17B10HRH1 | |
| SCHEMBL9085713 | 0.81 | CA12 (0.39) | CYP4A11CYP4F2CA1CA2CA12 | |
| SCHEMBL27323755 | 0.79 | ALDH1A1 (0.43) | CYP4A11CYP4F2LOXL2ALDH1A1TP53 | |
| SCHEMBL9050346 | 0.79 | CYP4A11 (0.61) | CYP4A11CYP4F2LOXL2ALDH1A1TP53 | |
| SCHEMBL20504197 | 0.78 | CYP4A11 (0.66) | CYP4A11CYP4F2LOXL2ALDH1A1TP53 | |
| SCHEMBL9206449 | 0.78 | CYP4A11 (0.66) | CYP4A11CYP4F2LOXL2ALDH1A1TP53 | |
| SCHEMBL10169575 | 0.76 | CYP4A11 (0.68) | CYP4A11CYP4F2LOXL2ALDH1A1TP53 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5496822-A | Compounds and methods for treating tumors | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-03-05 | — | — | US | disclosed |
| EP-0434426-A1 | Condensed heterocyclic compounds, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1991-06-26 | — | — | EP | disclosed |