Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6207923 | 0.76 | ALDH1A1 (0.50) | ALDH1A1HPGDKDM4EMAPK1POLB | |
| SCHEMBL2817102 | 0.73 | MAPK1 (0.50) | NPC1ALDH1A1HPGDKDM4EMAPK1 | |
| SCHEMBL9160024 | 0.73 | HSD11B1 (0.44) | ALDH1A1HPGDKDM4EMAPK1POLB | |
| SCHEMBL12208260 | 0.71 | HSD11B1 (0.56) | ALDH1A1HPGDKDM4EMAPK1POLB | |
| SCHEMBL1023276 | 0.71 | HSD11B1 (0.60) | ALDH1A1HPGDKDM4EMAPK1POLB | |
| SCHEMBL1647740 | 0.71 | MAPK1 (0.55) | ALDH1A1HPGDKDM4EMAPK1POLB | |
| SCHEMBL8310016 | 0.70 | NPC1 (0.56) | NPC1ALDH1A1MAPK1KMT2AMEN1 | |
| SCHEMBL13645822 | 0.70 | NPC1 (0.56) | NPC1ALDH1A1MAPK1KMT2AMEN1 | |
| SCHEMBL16602097 | 0.70 | NPC1 (0.56) | NPC1ALDH1A1MAPK1KMT2AMEN1 | |
| SCHEMBL27579582 | 0.70 | HSD11B1 (0.54) | ALDH1A1HPGDKDM4EMAPK1POLB |
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-115745823-B | Preparation method and application of compound | 武夷学院 | 2024-02-23 | — | — | CN | disclosed |