Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 6/20 | 0.38 |
| ▸ | PLK3 | Q9H4B4 | 6/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | SCN1A | P35498 | 2/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.33 |
| ▸ | SCN8A | Q9UQD0 | 2/20 | 0.33 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | IKBKE | Q14164 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | LPAR1 | Q92633 | 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 | |
|---|---|---|---|---|
| SCHEMBL18485943 | 0.88 | L3MBTL1 (0.36) | PLK1PLK3CYP2C9SCN1ASCN5A | |
| SCHEMBL19205718 | 0.87 | JAK2 (0.37) | PLK1PLK3CYP2C9SCN1ASCN5A | |
| SCHEMBL19205646 | 0.87 | JAK2 (0.37) | PLK1PLK3CYP2C9SCN1ASCN5A | |
| SCHEMBL19205645 | 0.87 | JAK2 (0.37) | PLK1PLK3CYP2C9SCN1ASCN5A | |
| SCHEMBL19205613 | 0.82 | ADRA2A (0.41) | PLK1PLK3CYP2C9ADRA2AADRA2B | |
| SCHEMBL19205692 | 0.82 | ADRA2A (0.41) | PLK1PLK3CYP2C9ADRA2AADRA2B | |
| SCHEMBL19205615 | 0.82 | ADRA2A (0.41) | PLK1PLK3CYP2C9ADRA2AADRA2B | |
| SCHEMBL19205668 | 0.72 | MAPT (0.33) | JAK2 | |
| SCHEMBL19205669 | 0.72 | MAPT (0.33) | JAK2 | |
| SCHEMBL18448779 | 0.68 | ADRA2A (0.48) | FFAR2ADRA2AADRA2BADRA2C |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017021879-A1 | NOVEL COMPOUNDS AS ROR GAMMA MODULATORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2017-02-09 | — | — | WO | disclosed |