Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.45 |
| ▸ | JAK1 | P23458 | 5/20 | 0.43 |
| ▸ | JAK3 | P52333 | 5/20 | 0.43 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.42 |
| ▸ | EZH2 | Q15910 | 2/20 | 0.42 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | ATR | Q13535 | 1/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | LCK | P06239 | 1/20 | 0.38 |
| ▸ | LYN | P07948 | 1/20 | 0.38 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | ZAP70 | P43403 | 1/20 | 0.38 |
| ▸ | SYK | P43405 | 1/20 | 0.38 |
| ▸ | TYRO3 | Q06418 | 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 | |
|---|---|---|---|---|
| SCHEMBL20111782 | 0.93 | LRRK2 (0.44) | HSP90AA1JAK1JAK3LRRK2EZH2 | |
| SCHEMBL20111740 | 0.75 | HSP90AA1 (0.47) | HSP90AA1JAK1JAK3EZH2KCNH2 | |
| SCHEMBL13277218 | 0.73 | EZH2 (0.59) | EZH2KCNH2MAPK1HDAC1 | |
| SCHEMBL31027903 | 0.73 | EZH2 (0.59) | EZH2KCNH2MAPK1HDAC1 | |
| SCHEMBL3683008 | 0.71 | PDE4B (0.47) | HSP90AA1JAK1JAK3LRRK2HSP90AB1 | |
| SCHEMBL1220618 | 0.71 | KDM4E (0.51) | HSP90AA1JAK1JAK3HSP90AB1KCNH2 | |
| SCHEMBL28051642 | 0.70 | EZH2 (0.44) | LRRK2EZH2PDE4BMAPK1HDAC3 | |
| SCHEMBL12191238 | 0.69 | JAK2 (0.52) | HSP90AA1JAK1JAK3HSP90AB1KCNH2 | |
| SCHEMBL13277912 | 0.69 | EZH2 (0.57) | EZH2PDE4BMAPK1HDAC3HDAC1 | |
| SCHEMBL2427377 | 0.69 | CREBBP (0.51) | HSP90AA1JAK1JAK3HSP90AB1KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018081530-A1 | COMPOSITIONS AND METHODS FOR TREATING EZH2-MEDIATED CANCER | ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) | 2018-05-03 | — | — | WO | disclosed |