Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK9 | P45984 | 1/20 | 0.41 |
| ▸ | CCNA2 | P20248 | 4/20 | 0.41 |
| ▸ | CDK2 | P24941 | 4/20 | 0.41 |
| ▸ | CCNA1 | P78396 | 4/20 | 0.41 |
| ▸ | CDK4 | P11802 | 4/20 | 0.41 |
| ▸ | CCND3 | P30281 | 4/20 | 0.41 |
| ▸ | GSK3B | P49841 | 4/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.40 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.40 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 3/20 | 0.40 |
| ▸ | MTOR | P42345 | 2/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.39 |
| ▸ | IDH1 | O75874 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL17618867 | 0.87 | MAPK9 (0.41) | MAPK9CCNA2CDK2CCNA1CDK4 | |
| SCHEMBL19670489 | 0.87 | CA2 (0.39) | CCNA2CDK2CCNA1CDK4CCND3 | |
| SCHEMBL19365904 | 0.82 | MAPT (0.43) | CA2CA9TRPV1NPC1SMN1; SMN2 | |
| SCHEMBL19670418 | 0.81 | MPL (0.42) | CA2CA9SCN9A | |
| SCHEMBL19670583 | 0.81 | KMT2A (0.39) | CA2CA9TRPV1MTOR | |
| SCHEMBL17618332 | 0.81 | KARS1 (0.43) | CA2CA9TRPV1MAPK13MAPK12 | |
| SCHEMBL17618331 | 0.81 | TRPV1 (0.41) | MAPK9CA2CA9TRPV1MAPK13 | |
| SCHEMBL19365254 | 0.80 | HTR2C (0.47) | TRPV1NPC1SMN1; SMN2 | |
| SCHEMBL19365368 | 0.80 | TRPA1 (0.38) | CA2CA9MTOR | |
| SCHEMBL19365708 | 0.80 | MAPT (0.41) | CA2CA9TRPV1MAPK14NPC1 |
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-9834558-B2 | Substituted bridged urea analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-12-05 | — | — | US | disclosed |