Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.45 |
| ▸ | NFKBIA | P25963 | 1/20 | 0.45 |
| ▸ | RELA | Q04206 | 1/20 | 0.45 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | TOP1 | P11387 | 2/20 | 0.41 |
| ▸ | MET | P08581 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | PTGES | O14684 | 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 | |
|---|---|---|---|---|
| SCHEMBL1538451 | 0.79 | NPC1 (0.57) | NPC1POLBRAB9AMAPTALDH1A1 | |
| SCHEMBL30038760 | 0.79 | NPC1 (0.57) | NPC1POLBRAB9AMAPTALDH1A1 | |
| SCHEMBL10436779 | 0.79 | NPC1 (0.49) | TRPV1SLC40A1NPC1POLBRAB9A | |
| SCHEMBL2976577 | 0.74 | CYP11B1 (0.48) | NPC1MAPTALDH1A1LMNAKDM4E | |
| SCHEMBL30340906 | 0.73 | NPC1 (0.70) | TRPV1NPC1POLBRAB9AMAPT | |
| SCHEMBL2963618 | 0.72 | ALDH1A1 (0.56) | NPC1POLBRAB9AMAPTALDH1A1 | |
| SCHEMBL5445828 | 0.71 | HSP90AA1 (0.62) | NFKBIARELASLC40A1NPC1POLB | |
| SCHEMBL14539004 | 0.71 | NPC1 (0.66) | NPC1POLBRAB9AMAPTALDH1A1 | |
| Quinoline SCHEMBL17439118 | 0.70 | ALDH1A1 (0.49) | NPC1POLBRAB9AMAPTALDH1A1 | |
| SCHEMBL31511355 | 0.69 | ALDH1A1 (0.50) | NPC1POLBRAB9AMAPTALDH1A1 |
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-0354994-A2 | Quinoline derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1990-02-21 | — | — | EP | disclosed |