Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 4/20 | 0.47 |
| ▸ | CDK4 | P11802 | 4/20 | 0.45 |
| ▸ | CCND1 | P24385 | 4/20 | 0.45 |
| ▸ | CDK2 | P24941 | 3/20 | 0.45 |
| ▸ | CDK1 | P06493 | 2/20 | 0.45 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.45 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.45 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.45 |
| ▸ | RET | P07949 | 1/20 | 0.45 |
| ▸ | CCND3 | P30281 | 2/20 | 0.44 |
| ▸ | CDK6 | Q00534 | 2/20 | 0.44 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.41 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.41 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 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 | |
|---|---|---|---|---|
| SCHEMBL3476963 | 0.83 | KCNH2 (0.35) | IKBKBCDK4CCND1CDK2CDK1 | |
| SCHEMBL3478504 | 0.83 | IKBKB (0.41) | IKBKBCDK4CCND1CDK2CDK1 | |
| SCHEMBL4491192 | 0.80 | IKBKB (0.41) | IKBKBCDK4CCND1CDK2CDK1 | |
| SCHEMBL4487841 | 0.80 | KCNH2 (0.40) | IKBKBCDK4CCND1CDK2CDK1 | |
| SCHEMBL16199971 | 0.80 | KCNH2 (0.41) | IKBKBCDK4CCND1CDK2CDK1 | |
| SCHEMBL4484036 | 0.79 | KCNH2 (0.35) | IKBKBCDK4CCND1CDK2CDK1 | |
| SCHEMBL4491170 | 0.79 | KCNH2 (0.35) | IKBKBCDK4CCND1CDK2CDK1 | |
| SCHEMBL3470774 | 0.78 | CDK9 (0.40) | IKBKBCDK4CCND1CDK2CDK1 | |
| SCHEMBL3478098 | 0.78 | LMNA (0.41) | IKBKBCDK4CCND1CDK2CDK1 | |
| SCHEMBL3477653 | 0.78 | KCNH2 (0.43) | CDK4CCND1CDK2CDK1CCNB1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1802357-A | 2-aminopyrimidine derivatives and their medical use | NOVARTIS AG (CH) | 2006-07-12 | — | — | CN | disclosed |