Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 1/20 | 0.47 |
| ▸ | APP | P05067 | 1/20 | 0.45 |
| ▸ | AKT1 | P31749 | 1/20 | 0.44 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.44 |
| ▸ | MTOR | P42345 | 1/20 | 0.44 |
| ▸ | VRK1 | Q99986 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | TGFBR1 | P36897 | 7/20 | 0.41 |
| ▸ | NPC1 | O15118 | 5/20 | 0.40 |
| ▸ | RAB9A | P51151 | 5/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL28357109 | 0.88 | PIK3CD (0.38) | DYRK1AAPPAKT1PIK3CAMTOR | |
| SCHEMBL28357096 | 0.78 | VRK1 (0.33) | VRK1TGFBR1 | |
| SCHEMBL6658073 | 0.76 | DYRK1A (0.60) | DYRK1AAPPAKT1PIK3CAMTOR | |
| SCHEMBL1671036 | 0.75 | NPC1 (0.54) | DYRK1AAPPAKT1PIK3CAMTOR | |
| SCHEMBL31214345 | 0.75 | DYRK1A (0.72) | DYRK1AAPPAKT1PIK3CAMTOR | |
| Ammonia Solution, Strong SCHEMBL28327531 | 0.73 | NPC1 (0.53) | DYRK1AAPPAKT1PIK3CAMTOR | |
| SCHEMBL28357177 | 0.72 | MAPK14 (0.49) | DYRK1AAPPAKT1PIK3CAMTOR | |
| Benzene SCHEMBL27557967 | 0.72 | NPC1 (0.53) | DYRK1AAPPAKT1PIK3CAMTOR | |
| Hydrazine SCHEMBL27557475 | 0.72 | NPC1 (0.51) | DYRK1AAPPAKT1PIK3CAMTOR | |
| SCHEMBL28357181 | 0.71 | PSMD11 (0.48) | PIK3CAMTORNPC1RAB9AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-110809577-A | Modulators of adenosine A2A receptor | 雷沃医疗有限公司 | 2020-02-18 | — | — | CN | claimed |
| CN-110809577-A | Modulators of adenosine A2A receptor | 雷沃医疗有限公司 | 2020-02-18 | — | — | CN | disclosed |