Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GGT1 | P19440 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | MLYCD | O95822 | 2/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.37 |
| ▸ | ACE | P12821 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | PLAAT3 | P53816 | 1/20 | 0.37 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.37 |
| ▸ | PLAAT2 | Q9NWW9 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29059381 | 0.80 | CYP1A2 (0.39) | CYP2C19CYP3A4CYP2D6CYP2C9CYP1A2 | |
| SCHEMBL29059374 | 0.80 | GGT1 (0.46) | GGT1CYP2C19CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL24298217 | 0.74 | ALDH1A1 (0.40) | GGT1ACE | |
| SCHEMBL24298266 | 0.74 | MEN1 (0.42) | KMT2AMEN1 | |
| SCHEMBL25362932 | 0.74 | MEN1 (0.42) | KMT2AMEN1 | |
| SCHEMBL7469306 | 0.74 | GGT1 (0.54) | GGT1CYP2C19CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7469320 | 0.74 | GGT1 (0.54) | GGT1CYP2C19CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL27699637 | 0.74 | MME (0.56) | GGT1KMT2ASIGMAR1ACE | |
| SCHEMBL8609013 | 0.74 | GGT1 (0.54) | GGT1CYP2C19CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL27699635 | 0.74 | MME (0.56) | GGT1KMT2ASIGMAR1ACE |
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-116783204-A | Modulators of cystic fibrosis transmembrane conductance regulator | 弗特克斯药品有限公司 | 2023-09-19 | — | — | CN | disclosed |
| CN-116601158-A | Modulators of cystic fibrosis transmembrane conductance regulator | 弗特克斯药品有限公司 | 2023-08-15 | — | — | CN | disclosed |