Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | ACP3 | P15309 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10049304 | 0.82 | TDP1 (0.47) | TDP1CYP1A2CYP2C19CYP2C9HPGD | |
| SCHEMBL3682565 | 0.82 | XPO1 (0.51) | TDP1CYP1A2CYP2C19CYP2C9HPGD | |
| SCHEMBL31683751 | 0.82 | TDP1 (0.47) | TDP1CYP1A2CYP2C19CYP2C9HPGD | |
| SCHEMBL24914145 | 0.80 | HPGD (0.49) | TDP1CYP1A2CYP2C19CYP2C9HPGD | |
| Hydrogen Peroxide SCHEMBL17838078 | 0.80 | TDP1 (0.53) | TDP1CYP1A2CYP2C19CYP2C9HPGD | |
| SCHEMBL6411524 | 0.79 | CYP1A2 (0.52) | TDP1CYP1A2CYP2C19CYP2C9HPGD | |
| SCHEMBL17595169 | 0.79 | TDP1 (0.53) | TDP1CYP1A2CYP2C19ACP3CYP2D6 | |
| SCHEMBL5830944 | 0.79 | CYP2C19 (0.56) | TDP1CYP1A2CYP2C19CYP2C9HPGD | |
| SCHEMBL5010806 | 0.76 | TDP1 (0.48) | TDP1CYP1A2CYP2C19CYP2C9HPGD | |
| SCHEMBL7924285 | 0.76 | CYP2C19 (0.48) | TDP1CYP1A2CYP2C19CYP2C9HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-4028118-A | AN ELECTRON-DONATING CHROMATIC COMPOUND, A PHENOLIC COMPOUND, A HIGHER ALIPHATIC ALCOHOL AND ESTER | PILOT INK CO., LTD. (JA) | 1977-06-07 | — | — | US | claimed |