Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORB | Q92753 | 9/20 | 0.40 |
| ▸ | RORC | P51449 | 5/20 | 0.40 |
| ▸ | TACR1 | P25103 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.35 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.34 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.34 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.34 |
| ▸ | CDC7 | O00311 | 1/20 | 0.34 |
| ▸ | PLK4 | O00444 | 1/20 | 0.34 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.34 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.34 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.34 |
| ▸ | DYRK3 | O43781 | 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 | |
|---|---|---|---|---|
| SCHEMBL4708690 | 0.89 | RORB (0.40) | RORBRORCTACR1GAAPTGER4 | |
| SCHEMBL4705944 | 0.89 | TACR1 (0.39) | RORBRORCTACR1GAAKDM4E | |
| SCHEMBL4705502 | 0.88 | RORB (0.39) | RORBRORCTACR1GAAKDM4E | |
| SCHEMBL4708285 | 0.88 | CDC7 (0.38) | RORBRORCTACR1GAACDC7 | |
| SCHEMBL4706783 | 0.87 | RORB (0.38) | RORBRORCTACR1GAAPTGER4 | |
| SCHEMBL4759328 | 0.87 | RORB (0.43) | RORBRORCTACR1GAAKDM4E | |
| SCHEMBL4707207 | 0.86 | RORB (0.40) | RORBRORCTACR1GAAKDM4E | |
| SCHEMBL4707706 | 0.85 | IDH1 (0.42) | RORBRORCTACR1PTGER4P2RX7 | |
| SCHEMBL4707926 | 0.84 | P2RX7 (0.36) | RORBRORCTACR1GAAP2RX7 | |
| SCHEMBL4705184 | 0.83 | TACR1 (0.44) | RORBRORCTACR1 |
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 |