Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.42 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 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 | |
|---|---|---|---|---|
| SCHEMBL28132419 | 0.83 | KMT2A (0.37) | KMT2ASMN1; SMN2NPC1RAB9ANFKB1 | |
| SCHEMBL2350601 | 0.77 | SMN1; SMN2 (0.45) | ALDH1A1KMT2ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL3116025 | 0.76 | SMN1; SMN2 (0.50) | ALDH1A1KMT2ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL10205907 | 0.74 | KMT2A (0.53) | ALDH1A1KMT2ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL28133229 | 0.74 | L3MBTL1 (0.47) | ALDH1A1KMT2ASMN1; SMN2RAB9AMAPT | |
| SCHEMBL13841426 | 0.73 | LMNA (0.55) | ALDH1A1KMT2ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL28133225 | 0.71 | ALDH1A1 (0.46) | ALDH1A1KMT2ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL8498568 | 0.71 | KCNJ1 (0.34) | GRM4 | |
| SCHEMBL25272300 | 0.70 | ALDH1A1 (0.44) | ALDH1A1KMT2ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL913164 | 0.70 | NPC1 (0.58) | ALDH1A1KMT2ASMN1; SMN2NPC1RAB9A |
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-106496130-A | A kind of methyl ketone derivatives and preparation method and application | 苏州大学 | 2017-03-15 | — | — | CN | disclosed |