Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 4/20 | 0.51 |
| ▸ | HRH4 | Q9H3N8 | 6/20 | 0.48 |
| ▸ | CDK4 | P11802 | 3/20 | 0.45 |
| ▸ | CCND1 | P24385 | 3/20 | 0.45 |
| ▸ | CDK1 | P06493 | 3/20 | 0.45 |
| ▸ | CDK2 | P24941 | 3/20 | 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 | 1/20 | 0.42 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.41 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.41 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.40 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15688949 | 0.80 | HRH4 (0.51) | IKBKBHRH4CDK4CCND1CDK1 | |
| SCHEMBL10187331 | 0.77 | CTSK (0.58) | HRH4CDK4CCND1CDK1CDK2 | |
| SCHEMBL12367075 | 0.75 | IKBKB (0.61) | IKBKBHRH4CDK4CCND1CDK1 | |
| SCHEMBL12367092 | 0.73 | HRH4 (0.47) | IKBKBHRH4CDK4CCND1CDK1 | |
| SCHEMBL10188247 | 0.73 | MAPK1 (0.62) | HRH4CDK2CCNA2RETMAPK10 | |
| SCHEMBL8303185 | 0.73 | HRH3 (0.59) | IKBKBHRH4CDK4CCND1CDK1 | |
| SCHEMBL31302407 | 0.72 | RPS6KB1 (0.42) | IKBKBHRH4KAT2B | |
| SCHEMBL13779899 | 0.71 | IKBKB (0.57) | IKBKBHRH4CDK4CCND1CDK1 | |
| SCHEMBL8959407 | 0.71 | HRH4 (0.45) | IKBKBHRH4CDK4CCND1CDK1 | |
| SCHEMBL14190850 | 0.71 | ADORA2A (0.56) | CDK4CCND1CDK1CDK2CCNA2 |
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-2066645-A2 | 2 AMINO-PYRIMIDINE DERIVATIVES AS H4 RECEPTOR ANTAGONISTS, PROCESSES FOR PREPARING THEM AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS | UCB Pharma S.A. (BE) | 2009-06-10 | — | — | EP | claimed |
| WO-2008031556-A2 | 2 AMINO-PYRIMIDINE DERIVATIVES AS H4 RECEPTOR ANTAGONISTS, PROCESSES FOR PREPARING THEM AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS | UCB PHARMA, S.A. (BE) | 2008-03-20 | — | — | WO | claimed |