Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 4/20 | 0.42 |
| ▸ | PPARG | P37231 | 3/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.39 |
| ▸ | RARG | P13631 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.39 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.39 |
| ▸ | PPARD | Q03181 | 2/20 | 0.38 |
| ▸ | CTSS | P25774 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8919939 | 0.84 | PAM (0.45) | PPARACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8921953 | 0.82 | MMP12 (0.39) | PPARAPPARGCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL19385923 | 0.76 | PPARG (0.56) | PPARAPPARGCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL8922517 | 0.73 | ACE (0.42) | ATMCTSSCTSLCTSBCTSK | |
| SCHEMBL2292391 | 0.72 | CTSK (0.56) | PPARAPPARGCYP1A2CTSLCTSB | |
| SCHEMBL3008826 | 0.72 | CTSK (0.56) | PPARAPPARGCYP1A2CTSLCTSB | |
| SCHEMBL7330324 | 0.72 | ITGA4 (0.47) | PPARAPPARGATMCTSSCTSL | |
| SCHEMBL7330326 | 0.72 | ITGA4 (0.47) | PPARAPPARGATMCTSSCTSL | |
| SCHEMBL30259385 | 0.71 | ATM (0.60) | PPARAPPARGATMCYP3A4PPARD | |
| SCHEMBL8921434 | 0.70 | ALDH1A1 (0.46) | PPARAPPARGCYP1A2CTSLCTSB |
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 |
|---|---|---|---|---|---|---|---|
| US-5633379-A | N-METHYLASPARTIC ACID ANTAGONIST | CIBA-GEIGY CORPORATION (US) | 1997-05-27 | — | — | US | disclosed |