Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CREBBP | Q92793 | 1/20 | 0.45 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.40 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.40 |
| ▸ | GSK3A | P49840 | 1/20 | 0.40 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.40 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.40 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.40 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15491013 | 0.84 | CREBBP (0.42) | CREBBPCHEK1AURKADAPK3CSNK1A1 | |
| SCHEMBL3608159 | 0.80 | CHEK1 (0.48) | CREBBPCHEK1AURKADAPK3CSNK1A1 | |
| SCHEMBL2595321 | 0.78 | KDM4E (0.53) | AKR1C4AKR1C3AKR1C2AKR1C1CYP3A4 | |
| SCHEMBL13462503 | 0.78 | CREBBP (0.44) | CREBBPCHEK1AURKADAPK3CSNK1A1 | |
| SCHEMBL3592818 | 0.75 | CREBBP (0.73) | CREBBPCHEK1AURKADAPK3CSNK1A1 | |
| SCHEMBL4555720 | 0.70 | CREBBP (0.64) | CREBBPCHEK1AURKADAPK3CSNK1A1 | |
| SCHEMBL30610195 | 0.68 | CREBBP (0.36) | CREBBPMAPK14 | |
| SCHEMBL30811759 | 0.68 | RXRA (0.47) | KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL11507800 | 0.67 | CREBBP (0.48) | CREBBPCHEK1AURKADAPK3CSNK1A1 | |
| SCHEMBL3603944 | 0.66 | IKBKE (0.49) | CREBBPCHEK1AURKADAPK3CSNK1A1 |
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-2681216-A2 | SUBSTITUTED 6,5-FUSED BICYCLIC HETEROARYL COMPOUNDS | Epizyme, Inc. (US) | 2014-01-08 | — | — | EP | disclosed |
| WO-2012118812-A2 | SUBSTITUTED 6,5-FUSED BICYCLIC HETEROARYL COMPOUNDS | Epizyme, Inc. (US) | 2012-09-07 | — | — | WO | disclosed |