Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | METAP2 | P50579 | 7/20 | 0.36 |
| ▸ | METAP1 | P53582 | 5/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PPID | Q08752 | 1/20 | 0.33 |
| ▸ | CAD | P27708 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18735337 | 0.90 | CYP1A2 (0.36) | CYP1A2CYP2C9CYP2C19HTTMETAP2 | |
| SCHEMBL18735330 | 0.90 | CYP2C9 (0.36) | CYP1A2CYP2C9CYP2C19HTTMETAP2 | |
| SCHEMBL18735065 | 0.86 | CYP1A2 (0.39) | CYP1A2CYP2C9CYP2C19HTTMETAP2 | |
| SCHEMBL18735361 | 0.83 | CYP1A2 (0.40) | CYP1A2CYP2C9CYP2C19HTTMETAP2 | |
| SCHEMBL18734954 | 0.82 | — | — | |
| SCHEMBL18735365 | 0.80 | CYP1A2 (0.35) | CYP1A2CYP2C9CYP2C19HTTMETAP2 | |
| SCHEMBL18735064 | 0.79 | CYP1A2 (0.43) | CYP1A2CYP2C9CYP2C19HTTMETAP2 | |
| SCHEMBL18735331 | 0.78 | METAP2 (0.33) | CYP1A2CYP2C9CYP2C19HTTMETAP2 | |
| SCHEMBL18735312 | 0.78 | METAP2 (0.36) | CYP1A2CYP2C9CYP2C19HTTMETAP2 | |
| SCHEMBL18735335 | 0.78 | L3MBTL1 (0.47) | CYP1A2CYP2C9CYP2C19HTTMETAP2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017060400-A1 | PROTECTED CARBOXYLIC ACID-BASED METABOLITES FOR THE TREATMENT OF DISESASES RELATED TO MITOCHONDRIAL DYSFUNCTIONS | NEUROVIVE PHARMACEUTICAL AB (SE) | 2017-04-13 | — | — | WO | disclosed |