Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | PPARA | Q07869 | 5/20 | 0.39 |
| ▸ | PPARG | P37231 | 4/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | FPR2 | P25090 | 1/20 | 0.39 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.39 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.39 |
| ▸ | ITGAV | P06756 | 1/20 | 0.39 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | PPARD | Q03181 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29633970 | 0.86 | LDHA (0.50) | LDHAALDH1A1PPARAPPARGFPR2 | |
| SCHEMBL22108590 | 0.86 | LDHA (0.50) | LDHAALDH1A1PPARAPPARGFPR2 | |
| SCHEMBL22108673 | 0.84 | LDHA (0.49) | LDHAALDH1A1PPARAPPARGATM | |
| SCHEMBL22444616 | 0.81 | ADRB3 (0.49) | LDHAPPARAPPARGFPR2ITGB3 | |
| SCHEMBL22445012 | 0.79 | LDHA (0.69) | LDHAALDH1A1PPARGATMFPR2 | |
| SCHEMBL10065588 | 0.79 | LDHA (0.69) | LDHAALDH1A1PPARGATMFPR2 | |
| SCHEMBL805254 | 0.79 | LDHA (0.69) | LDHAALDH1A1PPARGATMFPR2 | |
| SCHEMBL31267220 | 0.79 | LDHA (0.69) | LDHAALDH1A1PPARGATMFPR2 | |
| SCHEMBL23935830 | 0.78 | LDHA (0.47) | LDHAALDH1A1PPARAPPARGATM | |
| SCHEMBL22108989 | 0.76 | FOS (0.59) | LDHAALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3896056-A1 | AMINO ACID HAVING FUNCTIONAL GROUP CAPABLE OF INTERMOLECULAR HYDROGEN BONDING, PEPTIDE COMPOUND CONTAINING SAME AND METHOD FOR PRODUCTION THEREOF | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2021-10-20 | — | — | EP | disclosed |