Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.48 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | FLT3 | P36888 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL5164259 | 0.77 | ALDH1A1 (0.59) | TAS1R3TAS1R1NPC1RAB9AL3MBTL1 | |
| SCHEMBL5161483 | 0.77 | TAS1R3 (0.59) | HDAC3TAS1R3TAS1R1NPC1RAB9A | |
| SCHEMBL7027698 | 0.77 | PRSS1 (0.44) | ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2 | |
| SCHEMBL5162815 | 0.77 | HDAC3 (0.48) | HDAC3TAS1R3TAS1R1NPC1RAB9A | |
| SCHEMBL7097299 | 0.77 | KMT2A (0.44) | HDAC3ALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL5160036 | 0.75 | MAOB (0.42) | ALDH1A1KMT2ATSHRHPGDMAOB | |
| SCHEMBL5162442 | 0.74 | EGLN1 (0.39) | HDAC3 | |
| SCHEMBL5162750 | 0.74 | DRD2 (0.50) | L3MBTL1ALDH1A1FLT3MAPK1HPGD | |
| SCHEMBL5160003 | 0.73 | MGAM (0.44) | NPC1RAB9AALDH1A1MEN1KMT2A | |
| SCHEMBL5162412 | 0.73 | MGAM (0.48) | ALDH1A1LMNASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1340746-B1 | Process for the reduction of 3-heteroaryl-3-oxo-propanoic acid derivatives | SALTIGO GMBH (DE) | 2007-02-28 | — | — | EP | disclosed |
| EP-1340746-A1 | Process for the reduction of 3-heteroaryl-3-oxo-propanoic acid derivatives | BAYER AG (DE) | 2003-09-03 | — | — | EP | disclosed |