Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR139 | Q6DWJ6 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.38 |
| ▸ | FEN1 | P39748 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 2/20 | 0.38 |
| ▸ | SMO | Q99835 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29291324 | 0.83 | ALDH1A1 (0.55) | NPC1RAB9AALDH1A1POLBLMNA | |
| SCHEMBL29291334 | 0.81 | LMNA (0.49) | ALDH1A1CES2CES1LMNAMEN1 | |
| SCHEMBL29291312 | 0.76 | ALDH1A1 (0.48) | GPR139NPC1RAB9AALDH1A1MAPK1 | |
| SCHEMBL29291328 | 0.76 | LMNA (0.52) | NPC1RAB9AALDH1A1MAPK1MAPT | |
| SCHEMBL29291326 | 0.76 | NPC1 (0.51) | NPC1ALDH1A1MAPK1POLBMAPT | |
| SCHEMBL29291333 | 0.75 | LMNA (0.50) | NPC1RAB9AALDH1A1CES2CES1 | |
| SCHEMBL29291327 | 0.74 | ALDH1A1 (0.44) | NPC1RAB9AALDH1A1POLBMAPT | |
| SCHEMBL29291323 | 0.73 | CES2 (0.49) | NPC1RAB9ACES2CES1LMNA | |
| SCHEMBL29291325 | 0.73 | SMN1; SMN2 (0.46) | GPR139NPC1RAB9AALDH1A1POLB | |
| SCHEMBL44517 | 0.72 | LMNA (0.57) | GPR139NPC1RAB9AALDH1A1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109761842-B | Synthesis method of alpha-F-beta-NHAc-carbonyl compound | 浙江工业大学 | 2021-11-30 | — | — | CN | disclosed |