Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL22809557 | 0.82 | CYP1A2 (0.53) | CYP1A2CYP3A4CYP2C19RAB9ASMN1; SMN2 | |
| SCHEMBL19083678 | 0.79 | CYP1A2 (0.46) | CYP1A2CYP3A4CYP2C19RAB9ASMN1; SMN2 | |
| SCHEMBL14051590 | 0.79 | CYP1A2 (0.55) | CYP1A2CYP3A4CYP2C19RAB9ASMN1; SMN2 | |
| SCHEMBL22809449 | 0.78 | SCN9A (0.50) | CYP1A2CYP3A4CYP2C19RAB9ASMN1; SMN2 | |
| SCHEMBL11078962 | 0.78 | SMN1; SMN2 (0.53) | CYP1A2CYP3A4CYP2C19RAB9ASMN1; SMN2 | |
| SCHEMBL22809637 | 0.77 | ALDH1A1 (0.51) | CYP1A2CYP3A4CYP2C19RAB9ASMN1; SMN2 | |
| SCHEMBL28681177 | 0.76 | CYP1A2 (0.38) | CYP1A2CYP3A4CYP2C19RAB9ASMN1; SMN2 | |
| SCHEMBL16592103 | 0.76 | CYP1A2 (0.52) | CYP1A2CYP3A4CYP2C19RAB9ASMN1; SMN2 | |
| SCHEMBL13197550 | 0.76 | CYP1A2 (0.52) | CYP1A2CYP3A4CYP2C19RAB9ASMN1; SMN2 | |
| SCHEMBL19083879 | 0.75 | CYP1A2 (0.43) | CYP1A2CYP3A4CYP2C19RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3487839-B1 | AMIDE DERIVATIVES AS NAV1.7 AND NAV1.8 BLOCKERS | RAQUALIA PHARMA INC (JP) | 2020-12-23 | — | — | EP | disclosed |