Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.48 |
| ▸ | CYP2E1 | P05181 | 4/20 | 0.48 |
| ▸ | CYP2C8 | P10632 | 4/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.48 |
| ▸ | CYP2B6 | P20813 | 4/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | DAO | P14920 | 1/20 | 0.47 |
| ▸ | SYK | P43405 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL11177471 | 0.83 | GRM5 (0.50) | CYP1A2CYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL4208247 | 0.79 | NPC1 (0.47) | CYP1A2CYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL9719871 | 0.77 | DAO (0.41) | CYP1A2CYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL3388873 | 0.77 | L3MBTL1 (0.54) | CYP1A2CYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL11163593 | 0.77 | NPC1 (0.58) | SMN1; SMN2NPC1RAB9ADAOKDM4E | |
| SCHEMBL9719848 | 0.76 | MAPT (0.45) | SMN1; SMN2NPC1RAB9ADAOKDM4E | |
| SCHEMBL9719788 | 0.76 | SYK (0.46) | CYP1A2CYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL9719813 | 0.76 | SYK (0.52) | CYP1A2CYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL432670 | 0.76 | NPC1 (0.59) | CYP1A2CYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL29405082 | 0.76 | NPC1 (0.59) | CYP1A2CYP2E1CYP2C8CYP2D6CYP2C9 |
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-5157039-A | Lipoxygenase inhibitors | LEO PHARMACEUTICAL PRODUCTS LTD. (DK) | 1992-10-20 | — | — | US | disclosed |
| US-5109009-A | QUINOLINE AND PYRIDINE COMPOUNDS AND INHIBITION OF 5-LIPOXYGENASES THEREWITH | LEO PHARMACEUTICAL PRODUCTS LTD. (DK) | 1992-04-28 | — | — | US | disclosed |
| US-4826987-A | Pyridyl and quinoline derivatives | LEO PHARMACEUTICAL PRODUCTS LTD. (DK) | 1989-05-02 | — | — | US | disclosed |