Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.71 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.71 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.71 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.71 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.50 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL12490579 | 1.00 | CYP1A2 (0.71) | CYP1A2CYP2C9CYP2C19CYP3A4GPR119 | |
| SCHEMBL600179 | 0.98 | CYP1A2 (0.69) | CYP1A2CYP2C9CYP2C19CYP3A4GPR119 | |
| Lithium Ion SCHEMBL600178 | 0.85 | CYP1A2 (0.67) | CYP1A2CYP2C9CYP2C19CYP3A4GPR119 | |
| SCHEMBL600222 | 0.83 | CYP1A2 (1.00) | CYP1A2CYP2C9CYP2C19CYP3A4GPR119 | |
| SCHEMBL29664680 | 0.82 | MYC (0.54) | CYP1A2CYP2C9CYP2C19CYP3A4S1PR3 | |
| SCHEMBL18394604 | 0.82 | MYC (0.54) | CYP1A2CYP2C9CYP2C19CYP3A4S1PR3 | |
| SCHEMBL28183105 | 0.80 | MYC (0.50) | CYP1A2CYP2C9CYP2C19CYP3A4POLB | |
| SCHEMBL28574292 | 0.78 | CYP1A2 (0.46) | CYP1A2CYP2C9CYP2C19CYP3A4POLB | |
| SCHEMBL14862815 | 0.78 | CYP1A2 (0.57) | CYP1A2CYP2C9CYP2C19CYP3A4GPR119 | |
| SCHEMBL299335 | 0.77 | MAPT (0.65) | POLBALDH1A1MAPTMEN1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111386118-B | Combination pharmaceutical agents as RSV inhibitors | 英安塔制药有限公司 | 2023-05-09 | — | — | CN | disclosed |
| CN-108200760-B | Benzodiazepine derivatives as RSV inhibitors | 英安塔制药有限公司 | 2022-04-01 | — | — | CN | disclosed |