Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BMPR1B | O00238 | 4/20 | 0.39 |
| ▸ | BMPR1A | P36894 | 4/20 | 0.39 |
| ▸ | ACVRL1 | P37023 | 4/20 | 0.39 |
| ▸ | ACVR1 | Q04771 | 4/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.39 |
| ▸ | PIK3C3 | Q8NEB9 | 2/20 | 0.38 |
| ▸ | MERTK | Q12866 | 9/20 | 0.38 |
| ▸ | AXL | P30530 | 8/20 | 0.38 |
| ▸ | TGFBR1 | P36897 | 3/20 | 0.38 |
| ▸ | PRKAB2 | O43741 | 2/20 | 0.37 |
| ▸ | PRKAG1 | P54619 | 2/20 | 0.37 |
| ▸ | PRKAA2 | P54646 | 2/20 | 0.37 |
| ▸ | PRKAA1 | Q13131 | 2/20 | 0.37 |
| ▸ | PRKAG3 | Q9UGI9 | 2/20 | 0.37 |
| ▸ | PRKAG2 | Q9UGJ0 | 2/20 | 0.37 |
| ▸ | PRKAB1 | Q9Y478 | 2/20 | 0.37 |
| ▸ | PARP1 | P09874 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3469292 | 0.99 | BMPR1B (0.38) | BMPR1BBMPR1AACVRL1ACVR1LRRK2 | |
| SCHEMBL3469290 | 0.91 | BMPR1B (0.38) | BMPR1BBMPR1AACVRL1ACVR1LRRK2 | |
| SCHEMBL2497147 | 0.90 | BMPR1B (0.40) | BMPR1BBMPR1AACVRL1ACVR1LRRK2 | |
| SCHEMBL3952939 | 0.81 | ATR (0.40) | PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3 | |
| SCHEMBL3469184 | 0.80 | IKBKE (0.41) | BMPR1BBMPR1AACVRL1ACVR1LRRK2 | |
| SCHEMBL3469125 | 0.80 | CHRNA7 (0.43) | BMPR1BBMPR1AACVRL1ACVR1MERTK | |
| SCHEMBL3469241 | 0.79 | IKBKE (0.40) | BMPR1BBMPR1AACVRL1ACVR1LRRK2 | |
| SCHEMBL2497148 | 0.79 | ATR (0.34) | LRRK2PIK3C3PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL3469171 | 0.78 | CHRNA7 (0.40) | BMPR1BBMPR1AACVRL1ACVR1PIK3C3 | |
| SCHEMBL3469183 | 0.77 | HTT (0.45) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2215085-A2 | PYRIDINE AND PYRAZINE DERIVATIVES USEFUL IN THE TREATMENT OF CELL PROLIFERATIVE DISORDERS | AstraZeneca AB (SE) | 2010-08-11 | — | — | EP | disclosed |
| WO-2009053737-A2 | PYRIDINE AND PYRAZINE DERIVATIVES USEFUL IN THE TREATMENT OF CELL PROLIFERATIVE DISORDERS | ASTRAZENECA AB (SE) | 2009-04-30 | — | — | WO | disclosed |