Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.52 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | TLR4 | O00206 | 1/20 | 0.44 |
| ▸ | TLR2 | O60603 | 1/20 | 0.44 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.43 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9719825 | 0.85 | NPC1 (0.56) | CYP1A2TLR8TLR7SMN1; SMN2ALDH1A1 | |
| SCHEMBL20565351 | 0.81 | MAOB (0.56) | CYP1A2GAAMAPTMEN1ALDH1A1 | |
| SCHEMBL9719835 | 0.81 | APP (0.55) | GAAMAPTSMN1; SMN2ABCB1HTR1A | |
| SCHEMBL9719832 | 0.79 | F2 (0.58) | GAAMAPTABCB1HTR1ADRD2 | |
| SCHEMBL28044727 | 0.79 | CYP1A2 (0.49) | CYP1A2MAPTSMN1; SMN2MEN1ALDH1A1 | |
| SCHEMBL28807452 | 0.78 | TLR4 (0.49) | CYP1A2GAAMAPTSMN1; SMN2ABCB1 | |
| SCHEMBL8781060 | 0.77 | MEN1 (0.61) | CYP1A2SMN1; SMN2MEN1ALDH1A1KMT2A | |
| SCHEMBL791890 | 0.76 | FFAR1 (0.61) | ABCB1HTR1ADRD2TLR4TLR2 | |
| SCHEMBL12520413 | 0.76 | MTNR1B (0.60) | MAPTSMN1; SMN2MEN1ALDH1A1KMT2A | |
| SCHEMBL9719790 | 0.75 | SMN1; SMN2 (0.59) | GAAMAPTSMN1; SMN2MEN1KMT2A |
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 |