Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | RNF4 | P78317 | 1/20 | 0.43 |
| ▸ | FPR2 | P25090 | 1/20 | 0.43 |
| ▸ | LDHA | P00338 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | EPOR | P19235 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL7370982 | 0.81 | MMP8 (0.47) | PPARGGAAALDH1A1LMNANPC1 | |
| SCHEMBL7365185 | 0.79 | CTRB1 (0.43) | ALDH1A1LTA4HKMT2A | |
| Hydrochloric Acid SCHEMBL5967413 | 0.77 | SLC6A2 (0.45) | RAB9AALDH1A1LMNANPC1CNR2 | |
| SCHEMBL27724293 | 0.77 | ATM (0.45) | RAB9AGAAALDH1A1LMNAKMT2A | |
| SCHEMBL27724292 | 0.77 | ATM (0.45) | RAB9AGAAALDH1A1LMNAKMT2A | |
| SCHEMBL29131646 | 0.76 | ALPI (0.46) | ALDH1A1LMNA | |
| SCHEMBL7365769 | 0.76 | ALPI (0.46) | ALDH1A1LMNA | |
| SCHEMBL5399979 | 0.75 | ALDH1A1 (0.48) | PPARGPPARARAB9AGAAALDH1A1 | |
| SCHEMBL4144654 | 0.75 | MIF (0.49) | RAB9AALDH1A1LTA4HLMNANPC1 | |
| SCHEMBL4868746 | 0.75 | TRPM8 (0.48) | RAB9ALDHAALDH1A1LMNANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114890908-B | Gamma-trifluoromethyl amino acid derivative and preparation method thereof | 华中科技大学 | 2023-04-21 | — | — | CN | disclosed |
| CN-114890908-A | Gamma-position trifluoromethyl amino acid derivative and preparation method thereof | 华中科技大学 | 2022-08-12 | — | — | CN | disclosed |