Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.38 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.36 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 7/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | VCP | P55072 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | GPX4 | P36969 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7669449 | 0.81 | MAPT (0.34) | LMNAGPX4 | |
| SCHEMBL7668595 | 0.79 | GAA (0.40) | TRPV1KCNA5HTTGAAHPGD | |
| SCHEMBL7670861 | 0.75 | CHRNB2 (0.41) | KCNA5HTTHPGDLMNA | |
| SCHEMBL7666573 | 0.74 | ALDH1A1 (0.36) | LMNACYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9800218 | 0.73 | FAAH (0.47) | TRPV1HTTLMNA | |
| SCHEMBL9800223 | 0.73 | FAAH (0.47) | TRPV1HTTLMNA | |
| SCHEMBL7669223 | 0.72 | CHRNA7 (0.49) | HTTGAALMNA | |
| SCHEMBL7669029 | 0.72 | CHRNB2 (0.46) | KCNA5HTTHPGDLMNA | |
| SCHEMBL7669230 | 0.72 | CHRNA7 (0.49) | HTTGAALMNA | |
| SCHEMBL9718704 | 0.71 | RIPK1 (0.47) | HTTGAAHPGDLMNA |
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-5849768-A | α-unsaturated amines, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-12-15 | — | — | US | disclosed |