Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17186135 | 0.86 | CYP2A6 (0.39) | ALOX15CYP2A6ALDH1A1MAPK1KDM4E | |
| SCHEMBL9015179 | 0.79 | KDM4E (0.45) | CYP2A6ALDH1A1TDP1KDM4EMAPT | |
| SCHEMBL9015155 | 0.76 | CYP1A2 (0.35) | CYP2A6ALDH1A1KDM4EMAPTAHR | |
| SCHEMBL6088423 | 0.76 | ALDH1A1 (0.36) | CYP2A6ALDH1A1KDM4EMAPTMEN1 | |
| SCHEMBL5763105 | 0.76 | KDM4E (0.33) | ALDH1A1KDM4EMAPTNPC1S1PR4 | |
| SCHEMBL9015227 | 0.75 | KDM4E (0.39) | ALDH1A1KDM4EMAPTNPC1S1PR4 | |
| SCHEMBL9015207 | 0.73 | CRHBP (0.49) | CYP2A6ALDH1A1MAPK1TDP1KDM4E | |
| SCHEMBL7519550 | 0.72 | ATM (0.54) | CYP2A6ALDH1A1TDP1KDM4EMAPT | |
| SCHEMBL9015193 | 0.71 | CYP2A6 (0.47) | CYP2A6ALDH1A1MAPK1L3MBTL1KDM4E | |
| SCHEMBL9724136 | 0.69 | CYP2A6 (0.48) | CYP2A6ALDH1A1TDP1KDM4EMAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015107133-A1 | QUINOLINE DERIVATIVES AS INSECTICIDES AND ACARICIDES | BAYER CROPSCIENCE AG (DE) | 2015-07-23 | — | — | WO | disclosed |
| CN-1054845-C | Quinoline compounds | NOVARTIS AG (CH) | 2000-07-26 | — | — | CN | disclosed |
| US-5508408-A | LEUKOTRIENE ANTAGONISTS | CIBA-GEIGY CORPORATION (US) | 1996-04-16 | — | — | US | disclosed |
| CN-1105991-A | Quinoline compounds | CIBA GEIGY AG (CH) | 1995-08-02 | — | — | CN | disclosed |