Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.45 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.45 |
| ▸ | HSPA5 | P11021 | 5/20 | 0.44 |
| ▸ | FFAR2 | O15552 | 2/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | HSPA9 | P38646 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10660806 | 0.93 | RECQL (0.46) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL10946561 | 0.90 | NPC1 (0.44) | HSPA5RECQLTP53HTTL3MBTL1 | |
| SCHEMBL9839295 | 0.86 | HTT (0.48) | HSPA5FFAR2RECQLTP53HTT | |
| SCHEMBL10945760 | 0.84 | NPC1 (0.43) | HSPA5RECQLTP53HTTL3MBTL1 | |
| SCHEMBL10660923 | 0.84 | NPC1 (0.44) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL10665884 | 0.82 | SMN1; SMN2 (0.46) | HSPA5RECQLTP53HTTL3MBTL1 | |
| SCHEMBL10665753 | 0.78 | HTT (0.49) | HSPA5FFAR2RECQLTP53HTT | |
| SCHEMBL10665904 | 0.73 | HSPA5 (0.60) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL10946169 | 0.72 | NPC1 (0.48) | TAS1R3TAS1R1NPC1RAB9ANPSR1 | |
| SCHEMBL10660312 | 0.71 | TLR7 (0.47) | FFAR2NPSR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4736033-A | Certain 1,3-dihydro-1-[heterocyclic)imino]-furo-[3,4-b]quinoline 9-ol compounds having analgesic and anti-inflammatory activity | ROUSSEL UCLAF (FR) | 1988-04-05 | — | — | US | disclosed |
| US-4596875-A | Reacting benzoxazole compound with amide to decyclize, cyclizing to form quinoline derivative | ROUSSEL UCLAF (FR) | 1986-06-24 | — | — | US | disclosed |
| US-4486438-A | 4-Hydroxy-3-quinoline-carboxylic acid derivatives | ROUSSEL UCLAF (FR) | 1984-12-04 | — | — | US | disclosed |