Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HPGDS | O60760 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10518997 | 0.88 | ADORA2A (0.42) | SCN9AADORA2AALDH1A1CYP2C19NPC1 | |
| SCHEMBL9602628 | 0.84 | RAB9A (0.39) | ALDH1A1CYP2C19NPC1RAB9AHPGD | |
| SCHEMBL9601728 | 0.83 | SCN9A (0.51) | SCN9AADORA2AALDH1A1CYP2C19NPC1 | |
| SCHEMBL11125875 | 0.81 | ALDH1A1 (0.43) | SCN9AADORA2AALDH1A1NPC1RAB9A | |
| SCHEMBL9601963 | 0.81 | ALDH1A1 (0.43) | SCN9AADORA2AALDH1A1CYP2C19NPC1 | |
| SCHEMBL9605284 | 0.78 | RAB9A (0.39) | NPC1RAB9AHPGDSMN1; SMN2MEN1 | |
| SCHEMBL11148451 | 0.78 | NPC1 (0.45) | SCN9AALDH1A1NPC1RAB9AHPGD | |
| SCHEMBL9838903 | 0.77 | RAB9A (0.40) | CYP2C19NPC1RAB9AHPGDSMN1; SMN2 | |
| SCHEMBL9604885 | 0.74 | NPC1 (0.40) | NPC1RAB9AHPGDSMN1; SMN2MEN1 | |
| SCHEMBL9605133 | 0.73 | RAB9A (0.38) | CYP2C19NPC1RAB9AHPGDSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0214004-B1 | 4-OH-QUINOLINE-CARBOXYLIC-ACID DERIVATIVES SUBSTITUTED IN POSITION 2 BY A DIHYDROXY-SUBSTITUTED GROUP, POSSIBLY ETHERIFIED OR ESTERIFIED, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION, THEIR USE AS MEDICAMENTS AND COMPOSITIONS CONTAINING THEM | ROUSSEL-UCLAF (FR) | 1993-03-31 | — | — | EP | claimed |