Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 15/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | RGS4 | P49798 | 1/20 | 0.36 |
| ▸ | RGS8 | P57771 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL4051850 | 0.89 | ADORA3 (0.36) | ADORA3ADORA1TSHRKMT2AALDH1A1 | |
| SCHEMBL4003850 | 0.87 | ADORA3 (0.40) | ADORA3ADORA1ALDH1A1HPGD | |
| SCHEMBL3998824 | 0.87 | ADORA3 (0.40) | ADORA3ADORA1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL4056868 | 0.81 | ADORA3 (0.43) | ADORA3ADORA1KMT2AALDH1A1HPGD | |
| SCHEMBL4047524 | 0.76 | P2RX7 (0.35) | ADORA3ADORA1TSHRKMT2AALDH1A1 | |
| SCHEMBL4047255 | 0.76 | ROCK2 (0.38) | ADORA3ADORA1TSHRKMT2AALDH1A1 | |
| SCHEMBL4048842 | 0.76 | HPGD (0.43) | ADORA3ADORA1TSHRKMT2AALDH1A1 | |
| SCHEMBL4048843 | 0.76 | HPGD (0.43) | ADORA3ADORA1TSHRKMT2AALDH1A1 | |
| SCHEMBL4048840 | 0.74 | KIF11 (0.39) | ADORA1 | |
| SCHEMBL4054103 | 0.74 | KIF11 (0.62) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009074677-A2 | PYRAZOLOTRIAZINES | 4SC AG (DE) | 2009-06-18 | — | — | WO | disclosed |
| EP-2070932-A1 | Pyrazolotriazines | 4SC AG (DE) | 2009-06-17 | — | — | EP | disclosed |