Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | AKT3 | Q9Y243 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ERN1 | O75460 | 1/20 | 0.34 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.34 |
| ▸ | CDK2 | P24941 | 3/20 | 0.34 |
| ▸ | MAPK3 | P27361 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.34 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | TTK | P33981 | 1/20 | 0.33 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.33 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.32 |
| ▸ | CDK4 | P11802 | 1/20 | 0.32 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.32 |
| ▸ | CCND1 | P24385 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16192726 | 0.91 | IKBKB (0.35) | KCNH2AKT3KDM4ECCNA2CDK2 | |
| SCHEMBL3474930 | 0.89 | KCNH2 (0.38) | KCNH2AKT3KDM4EALDH1A1ROCK2 | |
| SCHEMBL3478518 | 0.89 | KCNH2 (0.38) | KCNH2AKT3KDM4EALDH1A1CCNA2 | |
| SCHEMBL27842565 | 0.84 | KCNH2 (0.36) | KCNH2CCNA2CDK2MAPK3MAPK1 | |
| SCHEMBL3478254 | 0.84 | CDK5 (0.40) | KCNH2CDK2KMT2AROCK2AURKA | |
| SCHEMBL4492222 | 0.83 | ROCK2 (0.42) | KCNH2CDK2KMT2AROCK2AURKA | |
| SCHEMBL3477263 | 0.82 | MKNK1 (0.45) | KCNH2CCNA2CDK2MAPK3MAPK1 | |
| SCHEMBL3477197 | 0.82 | IKBKB (0.37) | KCNH2AKT3KDM4EALDH1A1CCNA2 | |
| SCHEMBL4482067 | 0.81 | ROCK2 (0.47) | KCNH2CCNA2CDK2MAPK3MAPK1 | |
| SCHEMBL3478098 | 0.81 | LMNA (0.41) | KCNH2KDM4EALDH1A1CCNA2CDK2 |
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-1615898-B1 | 2-Aminopyrimidine derivatives and their medical use | NOVARTIS AG (CH) | 2014-10-29 | — | — | EP | claimed |
| WO-2010134939-A2 | MAMMALIAN GENES INVOLVED IN INFECTION | Zirus, Inc. (US) | 2010-11-25 | — | — | WO | disclosed |