Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.46 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL86076 | 1.00 | CYP19A1 (0.50) | CYP19A1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL5672208 | 0.92 | HPGD (0.44) | CYP19A1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL5672672 | 0.89 | CYP19A1 (0.43) | CYP19A1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL86321 | 0.82 | CYP19A1 (0.53) | CYP19A1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL30019143 | 0.82 | CYP19A1 (0.53) | CYP19A1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL12283811 | 0.78 | GPR84 (0.49) | CYP19A1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL12284409 | 0.78 | GPR84 (0.49) | CYP19A1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL12609510 | 0.77 | GPR84 (0.41) | CYP19A1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL30240788 | 0.77 | SMN1; SMN2 (0.54) | CYP19A1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL4254800 | 0.76 | CYP19A1 (0.50) | CYP19A1KDM4EALDH1A1HPGDHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117946031-A | Substituted aromatic phenol derivatives of KNa1.1 channel inhibitors | 北京大学 | 2024-04-30 | — | — | CN | disclosed |