Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | PTGES2 | Q9H7Z7 | 3/20 | 0.39 |
| ▸ | P4HB | P07237 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | FBP1 | P09467 | 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 | |
|---|---|---|---|---|
| SCHEMBL8001587 | 0.88 | ALDH1A1 (0.45) | NFE2L2MAPTSMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL8004163 | 0.87 | TSHR (0.42) | NFE2L2MAPTNPC1POLBRAB9A | |
| SCHEMBL7998337 | 0.81 | NFE2L2 (0.62) | NFE2L2CYP1A2CYP2C9RELAPTGES2 | |
| SCHEMBL7990203 | 0.80 | NFE2L2 (0.47) | NFE2L2CYP1A2CYP2C9MAOBMAOA | |
| SCHEMBL7988658 | 0.80 | PPARG (0.44) | MAPTNPC1POLBRAB9ACYP1A2 | |
| SCHEMBL7998331 | 0.78 | NFE2L2 (0.48) | NFE2L2MAPTSMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL7998940 | 0.77 | NFE2L2 (0.64) | NFE2L2RELAFBP1 | |
| SCHEMBL7988661 | 0.75 | PPARG (0.49) | NFE2L2MAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL8002291 | 0.75 | NFE2L2 (0.60) | NFE2L2RELAFBP1 | |
| SCHEMBL7998895 | 0.73 | NFE2L2 (0.41) | NFE2L2CYP1A2CYP2C9PTGES2FBP1 |
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-2009120783-A1 | HIGH AFFINITY INHIBITORS OF HEPATITIS C VIRUS NS3/4A PROTEASE | THE JOHNS HOPKINS UNIVERSITY (US) | 2009-10-01 | — | — | WO | disclosed |