Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR1 | P30556 | 2/20 | 0.46 |
| ▸ | KCNN3 | Q9UGI6 | 8/20 | 0.38 |
| ▸ | KCNN1 | Q92952 | 1/20 | 0.38 |
| ▸ | KCNN2 | Q9H2S1 | 1/20 | 0.38 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.36 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.36 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.36 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.36 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.36 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.36 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 2/20 | 0.35 |
| ▸ | CDK7 | P50613 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | CDK13 | Q14004 | 1/20 | 0.35 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7438339 | 0.96 | AGTR1 (0.44) | AGTR1KCNN3KCNN1KCNN2PRKAB2 | |
| SCHEMBL7445211 | 0.94 | AGTR1 (0.52) | AGTR1KCNN3KCNN1KCNN2PRKAB2 | |
| SCHEMBL7443544 | 0.89 | AGTR1 (0.41) | AGTR1KCNN3KCNN1KCNN2CDK2 | |
| SCHEMBL7487668 | 0.87 | PDE10A (0.41) | AGTR1KCNN3KCNN1KCNN2CDK2 | |
| SCHEMBL7439807 | 0.84 | GSK3B (0.49) | AGTR1CDK2 | |
| SCHEMBL7437203 | 0.83 | KCNN3 (0.47) | AGTR1KCNN3KCNN1KCNN2PRKAB2 | |
| SCHEMBL7436086 | 0.83 | GSK3B (0.41) | AGTR1 | |
| SCHEMBL7438615 | 0.83 | AGTR1 (0.42) | AGTR1CDK2 | |
| SCHEMBL7436199 | 0.82 | GSK3B (0.41) | AGTR1CDK2 | |
| SCHEMBL7433727 | 0.82 | DPP4 (0.34) | AGTR1CDK2CDK7CDK9CDK13 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0628559-B1 | Pyrimidine compounds and their use as pharmaceuticals | BEIERSDORF LILLY GMBH (DE) | 2002-04-03 | — | — | EP | disclosed |
| US-5602136-A | Pyrimidine compounds and their use as pharmaceuticals | BEIERSDORF-LILLY GMBH (DE) | 1997-02-11 | — | — | US | disclosed |
| US-5602137-A | Pyrimidine compounds and their use as pharmaceuticals | BEIERSDORF-LILLY GMBH (DE) | 1997-02-11 | — | — | US | disclosed |
| US-5571813-A | Fused pyrimidine compounds and their use as pharmaceuticals | BEIERSDORF-LILLY GMBH (DE) | 1996-11-05 | — | — | US | disclosed |
| EP-0628559-A1 | Pyrimidine compounds and their use as pharmaceuticals | Beiersdorf-Lilly GmbH (DE) | 1994-12-14 | — | — | EP | disclosed |