Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | TYK2 | P29597 | 1/20 | 0.32 |
| ▸ | JAK3 | P52333 | 1/20 | 0.32 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.31 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 3/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12128393 | 0.73 | HTT (0.47) | SMN1; SMN2NPC1RAB9AALDH1A1L3MBTL1 | |
| SCHEMBL25360339 | 0.72 | MEN1 (0.37) | SMN1; SMN2HTTCRBNMEN1KMT2A | |
| SCHEMBL535681 | 0.72 | HTT (0.36) | SMN1; SMN2HTTMEN1KMT2AKDM4E | |
| SCHEMBL959784 | 0.72 | MEN1 (0.37) | SMN1; SMN2ALDH1A1L3MBTL1HTTMEN1 | |
| SCHEMBL23536405 | 0.71 | HTR2C (0.39) | SMN1; SMN2NPC1RAB9AALDH1A1HTT | |
| SCHEMBL14901206 | 0.69 | HTT (0.34) | SMN1; SMN2ALDH1A1HTTMEN1KMT2A | |
| SCHEMBL2158360 | 0.69 | HTT (0.34) | SMN1; SMN2HTTMEN1KMT2A | |
| SCHEMBL3024635 | 0.69 | SMN1; SMN2 (0.35) | SMN1; SMN2HTTMEN1KMT2AKDM4E | |
| SCHEMBL16125119 | 0.69 | SORD (0.37) | SMN1; SMN2ALDH1A1HTTMEN1KMT2A | |
| SCHEMBL877521 | 0.68 | CRBN (0.35) | NPC1RAB9AALDH1A1L3MBTL1HTT |
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-1904451-A1 | ARYL-ALKYLAMINES AND HETEROARYL-ALKYLAMINES AS PROTEIN KINASE INHIBITORS | Astex Therapeutics Limited (GB) | 2008-04-02 | — | — | EP | disclosed |
| WO-2006136830-A1 | ARYL-ALKYLAMINES AND HETEROARYL-ALKYLAMINES AS PROTEIN KINASE INHIBITORS | ASTEX THERAPEUTICS LIMITED (GB) | 2006-12-28 | — | — | WO | disclosed |