Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 14/20 | 0.37 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA3 | P07451 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA6 | P23280 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4404049 | 0.83 | CA1 (0.45) | IRAK4CISD1CA12CA1CA2 | |
| SCHEMBL31436651 | 0.83 | CA1 (0.45) | IRAK4CISD1CA12CA1CA2 | |
| SCHEMBL15690953 | 0.82 | JAK1 (0.40) | IRAK4ALDH1A1MEN1KMT2ACHEK1 | |
| SCHEMBL18341540 | 0.81 | CISD1 (0.36) | IRAK4CISD1CA12CA1CA2 | |
| SCHEMBL30883513 | 0.81 | CA1 (0.52) | IRAK4CISD1CA12CA1CA2 | |
| SCHEMBL21949044 | 0.81 | CA1 (0.52) | IRAK4CISD1CA12CA1CA2 | |
| SCHEMBL18341774 | 0.81 | CISD1 (0.38) | IRAK4CISD1CA12CA1CA2 | |
| SCHEMBL23335135 | 0.80 | BPTF (0.41) | CISD1CA12CA1CA2CA3 | |
| SCHEMBL16873023 | 0.80 | IRAK4 (0.40) | IRAK4CISD1CA12CA1CA2 | |
| SCHEMBL21949096 | 0.80 | CA1 (0.54) | IRAK4CISD1CA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2922840-A1 | BICYCLIC HETEROCYCLE SUBSTITUTED PYRIDYL COMPOUNDS USEFUL AS KINASE MODULATORS | Bristol-Myers Squibb Company (US) | 2015-09-30 | — | — | EP | disclosed |
| EP-2917206-A1 | HETEROARYL SUBSTITUTED PYRIDYL COMPOUNDS USEFUL AS KINASE MODULATORS | Bristol-Myers Squibb Company (US) | 2015-09-16 | — | — | EP | disclosed |