Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.97 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.82 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.82 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.71 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.68 |
| ▸ | TSHR | P16473 | 1/20 | 0.67 |
| ▸ | HRH1 | P35367 | 3/20 | 0.64 |
| ▸ | DRD1 | P21728 | 2/20 | 0.64 |
| ▸ | DRD4 | P21917 | 2/20 | 0.64 |
| ▸ | DRD5 | P21918 | 2/20 | 0.64 |
| ▸ | DRD3 | P35462 | 2/20 | 0.64 |
| ▸ | DRD2 | P14416 | 1/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.63 |
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL8351940 | 1.00 | TDP1 (0.97) | TDP1CYP2D6CYP2C19KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL14966281 | 0.98 | TDP1 (0.94) | TDP1CYP2D6CYP2C19KDM4EALDH1A1 | |
| SCHEMBL8264564 | 0.98 | TDP1 (1.00) | TDP1CYP2D6CYP2C19KDM4EALDH1A1 | |
| SCHEMBL22610054 | 0.89 | CYP2D6 (0.85) | TDP1CYP2D6CYP2C19KDM4EALDH1A1 | |
| SCHEMBL13924773 | 0.87 | TDP1 (0.79) | TDP1CYP2D6CYP2C19KDM4EALDH1A1 | |
| SCHEMBL14410108 | 0.85 | TDP1 (0.77) | TDP1CYP2D6CYP2C19ALDH1A1SMN1; SMN2 | |
| SCHEMBL28329084 | 0.85 | TDP1 (0.77) | TDP1CYP2D6CYP2C19KDM4EALDH1A1 | |
| SCHEMBL12058633 | 0.84 | TDP1 (0.74) | TDP1CYP2D6CYP2C19KDM4ESMN1; SMN2 | |
| SCHEMBL11360251 | 0.84 | TDP1 (0.74) | TDP1CYP2D6CYP2C19KDM4EALDH1A1 | |
| SCHEMBL11599933 | 0.82 | L3MBTL1 (0.68) | TDP1CYP2D6CYP2C19ALDH1A1TSHR |
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-2013074965-A1 | AMINOALKYL PHENOL ETHER INHIBITORS OF INFLUENZA A VIRUS | MICROBIOTIX, INC. (US) | 2013-05-23 | — | — | WO | disclosed |