Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.50 |
| ▸ | ABCG2 | Q9UNQ0 | 4/20 | 0.49 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.48 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29054179 | 1.00 | NCEH1 (0.50) | NCEH1ABCG2CYP1B1CYP1A1MEN1 | |
| SCHEMBL14149856 | 1.00 | NCEH1 (0.50) | NCEH1ABCG2CYP1B1CYP1A1MEN1 | |
| SCHEMBL14052575 | 0.83 | ABCG2 (0.55) | ABCG2CYP1B1CYP1A1MEN1KMT2A | |
| SCHEMBL8210028 | 0.83 | ABCG2 (0.55) | ABCG2CYP1B1CYP1A1MEN1KMT2A | |
| SCHEMBL14052574 | 0.83 | ABCG2 (0.55) | ABCG2CYP1B1CYP1A1MEN1KMT2A | |
| SCHEMBL8210024 | 0.83 | ABCG2 (0.55) | ABCG2CYP1B1CYP1A1MEN1KMT2A | |
| SCHEMBL31497571 | 0.82 | NCEH1 (0.55) | NCEH1MEN1KMT2ARAB9APOLB | |
| SCHEMBL14052619 | 0.80 | ABCG2 (0.49) | NCEH1ABCG2CYP1B1CYP1A1RAB9A | |
| SCHEMBL14052620 | 0.80 | ABCG2 (0.49) | NCEH1ABCG2CYP1B1CYP1A1RAB9A | |
| SCHEMBL5134400 | 0.78 | NCEH1 (0.51) | NCEH1MEN1KMT2APOLBSMN1; SMN2 |
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-116143602-A | Indenone and indazolone derivatives with antioxidant activity, and synthetic method and application thereof | 西南大学 | 2023-05-23 | — | — | CN | disclosed |