Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 5/20 | 0.46 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.39 |
| ▸ | CDK8 | P49336 | 1/20 | 0.38 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.38 |
| ▸ | AXL | P30530 | 1/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4495480 | 0.86 | ALDH1A1 (0.42) | ERN1KDM5BALDH1A1RAB9ACA12 | |
| SCHEMBL4491011 | 0.82 | SMN1; SMN2 (0.44) | ALDH1A1RAB9AMAPTKMT2ASMN1; SMN2 | |
| SCHEMBL4495792 | 0.77 | ERN1 (0.47) | ERN1ALDH1A1RAB9ACA12CA1 | |
| SCHEMBL4492959 | 0.72 | CA12 (0.41) | ERN1ALDH1A1RAB9ACA12CA1 | |
| SCHEMBL4485738 | 0.72 | MTNR1A (0.41) | ALDH1A1POLBKMT2A | |
| SCHEMBL4504198 | 0.71 | LDHA (0.38) | KDM5BALDH1A1POLBMAPTBLM | |
| SCHEMBL20074249 | 0.71 | KDM5B (0.54) | ERN1KDM5BALDH1A1GABRG2GABRB3 | |
| SCHEMBL31676974 | 0.71 | KDM5B (0.54) | ERN1KDM5BALDH1A1GABRG2GABRB3 | |
| SCHEMBL4491747 | 0.70 | MEN1 (0.40) | ALDH1A1RAB9APOLBMAPTKMT2A | |
| SCHEMBL4496742 | 0.70 | CCR1 (0.36) | ALDH1A1RAB9A |
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-7504429-B2 | Tyrosine kinase inhibitors | MERCK & CO., INC. (US) | 2009-03-17 | — | — | US | claimed |