Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC7 | O00311 | 9/20 | 0.38 |
| ▸ | RORB | Q92753 | 5/20 | 0.37 |
| ▸ | RORC | P51449 | 3/20 | 0.37 |
| ▸ | TACR1 | P25103 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.36 |
| ▸ | PIM1 | P11309 | 2/20 | 0.36 |
| ▸ | PRKACA | P17612 | 2/20 | 0.36 |
| ▸ | CDK2 | P24941 | 2/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | CHUK | O15111 | 1/20 | 0.36 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.36 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.36 |
| ▸ | PRKCG | P05129 | 1/20 | 0.36 |
| ▸ | CDK1 | P06493 | 1/20 | 0.36 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.36 |
| ▸ | MARK3 | P27448 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4707181 | 0.88 | RORB (0.40) | CDC7RORBRORCTACR1ROCK2 | |
| SCHEMBL4705642 | 0.86 | RORB (0.40) | CDC7RORBRORCTACR1ROCK2 | |
| SCHEMBL4705944 | 0.85 | TACR1 (0.39) | RORBRORCTACR1GAAKCNJ6 | |
| SCHEMBL4708690 | 0.85 | RORB (0.40) | CDC7RORBRORCTACR1GAA | |
| SCHEMBL4706783 | 0.83 | RORB (0.38) | CDC7RORBRORCTACR1MAPK1 | |
| SCHEMBL4708438 | 0.82 | CDC7 (0.41) | CDC7TACR1ROCK2PIM1PRKACA | |
| SCHEMBL4707207 | 0.82 | RORB (0.40) | RORBRORCTACR1GAA | |
| SCHEMBL4707706 | 0.81 | IDH1 (0.42) | RORBRORCTACR1KDRCRHR1 | |
| SCHEMBL4707926 | 0.80 | P2RX7 (0.36) | RORBRORCTACR1GAA | |
| SCHEMBL4706857 | 0.80 | CDC7 (0.37) | CDC7RORBRORCTACR1ROCK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1501809-B1 | TRIAZOLE DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-01-16 | — | — | EP | disclosed |