Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 8/20 | 0.55 |
| ▸ | POLB | P06746 | 2/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | CDK4 | P11802 | 1/20 | 0.54 |
| ▸ | CCND1 | P24385 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 5/20 | 0.50 |
| ▸ | GBA1 | P04062 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | SYK | P43405 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4776165 | 0.91 | CCKBR (0.52) | KMT2APOLBNPC1RAB9ACDK4 | |
| SCHEMBL3962080 | 0.85 | CDK4 (0.58) | KMT2APOLBNPC1RAB9ACDK4 | |
| SCHEMBL2240341 | 0.83 | CDK4 (0.50) | KMT2ANPC1RAB9ACDK4CCND1 | |
| SCHEMBL4766014 | 0.82 | ADORA1 (0.47) | POLBNPC1RAB9AGBA1ALDH1A1 | |
| SCHEMBL4771758 | 0.82 | ADORA1 (0.43) | KMT2APOLBNPC1RAB9AADORA3 | |
| SCHEMBL4770635 | 0.81 | CYP1A2 (0.52) | MAPTALDH1A1GAAADORA3ADORA2A | |
| SCHEMBL4773065 | 0.81 | ADORA1 (0.43) | POLBNPC1RAB9AADORA3ADORA2A | |
| SCHEMBL4776020 | 0.81 | CDK4 (0.49) | KMT2ACDK4CCND1MEN1GAA | |
| SCHEMBL4768684 | 0.81 | ADORA2A (0.43) | KMT2AADORA3ADORA2AADORA1 | |
| SCHEMBL4765953 | 0.80 | LMNA (0.52) | NPC1RAB9AALDH1A1SMN1; SMN2LMNA |
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 |