Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.51 |
| ▸ | KMO | O15229 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.42 |
| ▸ | PIK3R2 | O00459 | 2/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.42 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.42 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.42 |
| ▸ | PIK3R5 | Q8WYR1 | 2/20 | 0.42 |
| ▸ | PIK3R3 | Q92569 | 2/20 | 0.42 |
| ▸ | CFTR | P13569 | 7/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 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 | |
|---|---|---|---|---|
| SCHEMBL16517783 | 0.91 | MAP3K14 (0.60) | MAP3K14PIK3CDPIK3R2PIK3CAPIK3CB | |
| SCHEMBL16532623 | 0.88 | MAP3K14 (0.50) | MAP3K14ALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL16516737 | 0.76 | MAP3K14 (0.44) | MAP3K14ALDH1A1SMN1; SMN2KDM4EPOLB | |
| SCHEMBL16547228 | 0.75 | MAP3K14 (0.52) | MAP3K14ALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL16516760 | 0.74 | RPA1 (0.40) | MAP3K14ALDH1A1SMN1; SMN2KMT2AKDM4E | |
| SCHEMBL16517335 | 0.72 | MAP3K14 (0.46) | MAP3K14ALDH1A1SMN1; SMN2KDM4EPOLB | |
| SCHEMBL16516832 | 0.71 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E | |
| SCHEMBL16517541 | 0.71 | RPA1 (0.47) | MAP3K14ALDH1A1SMN1; SMN2KMT2AKDM4E | |
| SCHEMBL16517674 | 0.71 | MAP3K14 (0.49) | MAP3K14ALDH1A1SMN1; SMN2KDM4ERAB9A | |
| SCHEMBL17233522 | 0.70 | PDE4A (0.57) | MAP3K14ALDH1A1MEN1KMT2AKDM4E |
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-3036230-A1 | ALKYNYL ALCOHOLS AND METHODS OF USE | F. Hoffmann-La Roche AG (CH) | 2016-06-29 | — | — | EP | disclosed |
| WO-2015025025-A1 | ALKYNYL ALCOHOLS AND METHODS OF USE | F. HOFFMANN-LA ROCHE AG (CH) | 2015-02-26 | — | — | WO | disclosed |