Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 8/20 | 0.59 |
| ▸ | CES1 | P23141 | 8/20 | 0.59 |
| ▸ | RAB9A | P51151 | 4/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | XBP1 | P17861 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | VCP | P55072 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28892760 | 0.92 | ALDH1A1 (0.64) | CES2CES1RAB9AALDH1A1MAPT | |
| SCHEMBL28425331 | 0.86 | ALDH1A1 (0.54) | CES2CES1RAB9AALDH1A1MAPT | |
| SCHEMBL28424518 | 0.83 | CES2 (0.63) | CES2CES1RAB9AALDH1A1MAPT | |
| SCHEMBL11339856 | 0.83 | CES2 (0.54) | CES2CES1RAB9AALDH1A1MAPT | |
| SCHEMBL11558620 | 0.83 | CES2 (0.54) | CES2CES1RAB9AALDH1A1MAPT | |
| SCHEMBL9447416 | 0.83 | ALDH1A1 (0.47) | CES2CES1RAB9AALDH1A1MAPT | |
| SCHEMBL9447417 | 0.83 | ALDH1A1 (0.47) | CES2CES1RAB9AALDH1A1MAPT | |
| SCHEMBL28968054 | 0.80 | RAB9A (0.51) | CES2CES1RAB9AALDH1A1MAPT | |
| SCHEMBL12588773 | 0.79 | ALDH1A1 (0.66) | CES2CES1RAB9AALDH1A1MAPT | |
| SCHEMBL11341276 | 0.79 | ALDH1A1 (0.66) | CES2CES1RAB9AALDH1A1MAPT |
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-111393322-B | Cyclization synthesis method of naphthalocyanide and derivative thereof | 石河子大学 | 2023-03-17 | — | — | CN | disclosed |
| CN-111393322-A | Cyclization synthesis method of naphthalocyanide and derivative thereof | 石河子大学 | 2020-07-10 | — | — | CN | disclosed |