Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 8/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 7/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.43 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.40 |
| ▸ | IDE | P14735 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.39 |
| ▸ | BCR | P11274 | 1/20 | 0.39 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.39 |
| ▸ | PRKCA | P17252 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | CDC7 | O00311 | 1/20 | 0.38 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.38 |
| ▸ | PRKACA | P17612 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4769061 | 0.82 | ADORA2A (0.43) | ADORA2AADORA1ADORA3ADORA2BIDE | |
| SCHEMBL4766014 | 0.82 | ADORA1 (0.47) | ADORA2AADORA1ADORA3ADORA2BCYP3A4 | |
| SCHEMBL4771758 | 0.82 | ADORA1 (0.43) | ADORA2AADORA1ADORA3ADORA2BKMT2A | |
| SCHEMBL4773065 | 0.81 | ADORA1 (0.43) | ADORA2AADORA1ADORA3ADORA2BCDC7 | |
| SCHEMBL4769102 | 0.81 | KMT2A (0.55) | ADORA2AADORA1ADORA3KMT2A | |
| SCHEMBL4765953 | 0.78 | LMNA (0.52) | CYP2C9 | |
| SCHEMBL4770635 | 0.78 | CYP1A2 (0.52) | ADORA2AADORA1ADORA3CYP3A4EGFR | |
| SCHEMBL4773415 | 0.77 | ADORA2A (0.43) | ADORA2AADORA1ADORA3ADORA2BIDE | |
| SCHEMBL4768829 | 0.76 | KDM4E (0.44) | ADORA2AADORA1ADORA3ADORA2BKMT2A | |
| SCHEMBL4775234 | 0.75 | LMNA (0.49) | CYP2C9 |
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-1878733-A1 | Pyrimidine derivatives as ALK-5 inhibitors | Novartis AG (CH) | 2008-01-16 | — | — | EP | disclosed |