Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 10/20 | 0.40 |
| ▸ | FBP1 | P09467 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 2/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | PPARA | Q07869 | 2/20 | 0.34 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.33 |
| ▸ | NR5A1 | Q13285 | 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 | |
|---|---|---|---|---|
| SCHEMBL21331844 | 0.88 | SLC22A12 (0.46) | SLC22A12CYP3A4CYP2C9KDM4E | |
| SCHEMBL21350905 | 0.85 | SLC22A12 (0.40) | SLC22A12CYP3A4CYP2C9 | |
| SCHEMBL21350903 | 0.85 | PPARA (0.39) | SLC22A12FBP1CYP3A4PPARAABCB11 | |
| SCHEMBL21350534 | 0.83 | SLC22A12 (0.56) | SLC22A12FBP1 | |
| SCHEMBL21350902 | 0.82 | SLC22A12 (0.41) | SLC22A12KDM4EL3MBTL1 | |
| SCHEMBL21350308 | 0.82 | LATS1 (0.41) | SLC22A12CNR2CNR1CYP3A4CYP2C9 | |
| SCHEMBL21350528 | 0.82 | SLC22A12 (0.53) | SLC22A12CNR2CNR1CYP3A4CYP2C9 | |
| SCHEMBL21350641 | 0.77 | CYP4F2 (0.47) | SLC22A12CYP3A4CYP1A2CYP2C9KDM4E | |
| SCHEMBL21331848 | 0.77 | SLC22A12 (0.48) | SLC22A12CYP3A4CYP2C9KDM4E | |
| SCHEMBL28414576 | 0.76 | SLC22A12 (0.46) | SLC22A12CYP3A4CYP2C9 |
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-2019169890-A1 | 3-(NAPHTHALENE-1-METHYL SUBSTITUTED)PYRIDINE DERIVATIVE, SYNTHETIC METHOD THEREFOR AND USE THEREOF | 南方医科大学 | 2019-09-12 | — | — | WO | disclosed |