Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 8/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL29555314 | 0.81 | SIGMAR1 (0.63) | SIGMAR1CYP1A2CYP2C19CYP2D6CYP2A6 | |
| SCHEMBL27737084 | 0.81 | SIGMAR1 (0.63) | SIGMAR1CYP1A2CYP2C19CYP2D6CYP2A6 | |
| SCHEMBL2349 | 0.81 | SIGMAR1 (0.63) | SIGMAR1CYP1A2CYP2C19CYP2D6CYP2A6 | |
| SCHEMBL7478328 | 0.81 | SIGMAR1 (0.52) | SIGMAR1CYP1A2CYP2C19CYP2D6CYP2A6 | |
| SCHEMBL1683320 | 0.81 | SIGMAR1 (0.63) | SIGMAR1CYP1A2CYP2C19CYP2D6CYP2A6 | |
| SCHEMBL29364795 | 0.81 | SIGMAR1 (0.63) | SIGMAR1CYP1A2CYP2C19CYP2D6CYP2A6 | |
| SCHEMBL998560 | 0.79 | SIGMAR1 (0.52) | SIGMAR1CYP1A2CYP2C19ALDH1A1KDM4E | |
| Hydrogen Sulfide SCHEMBL3359211 | 0.79 | SIGMAR1 (0.61) | SIGMAR1CYP1A2CYP2C19CYP2D6CYP2A6 | |
| SCHEMBL2173531 | 0.79 | SIGMAR1 (0.61) | SIGMAR1CYP1A2CYP2C19CYP2D6CYP2A6 | |
| Hydrochloric Acid SCHEMBL2866027 | 0.79 | SIGMAR1 (0.61) | SIGMAR1CYP1A2CYP2C19CYP2D6CYP2A6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0818512-B1 | Quinoline derivative and use of same | MITSUI CHEMICALS INC (JP) | 2002-10-02 | — | — | EP | disclosed |
| US-6407242-B1 | REACTING A PHTHALIMIDE COMPOUND WITH A QUINOLINE COMPOUND;ELECTROLUMINESCENCE | MITSUI CHEMICALS, INC. (JP) | 2002-06-18 | — | — | US | disclosed |
| US-6132640-A | ZINC COMPLEXES OF QUINOLINE | MITSUI CHEMICALS, INC. (JP) | 2000-10-17 | — | — | US | disclosed |
| EP-0818512-A1 | Quinoline derivative and use of same | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1998-01-14 | — | — | EP | disclosed |