Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.39 |
| ▸ | AHR | P35869 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | GABRP | O00591 | 1/20 | 0.38 |
| ▸ | GABRD | O14764 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18342460 | 0.84 | CYP1A2 (0.46) | PLK1CYP1A2RAB9AMAPTNPC1 | |
| SCHEMBL3616211 | 0.83 | CYP1A2 (0.49) | PLK1CYP1A2RAB9AMAPTNPC1 | |
| SCHEMBL14897914 | 0.81 | ALDH1A1 (0.48) | CYP1A2RAB9AMAPTNPC1KDM4E | |
| SCHEMBL18342357 | 0.80 | CYP1A2 (0.45) | PLK1CYP1A2RAB9AMAPTNPC1 | |
| SCHEMBL9757082 | 0.79 | ELANE (0.44) | PLK1CYP1A2KDM4EHSD17B10ELANE | |
| SCHEMBL28669556 | 0.79 | CYP1A2 (0.44) | PLK1CYP1A2RAB9AMAPTNPC1 | |
| SCHEMBL3621004 | 0.75 | RAB9A (0.53) | CYP1A2RAB9AMAPTNPC1KDM4E | |
| SCHEMBL9757007 | 0.74 | CYP4F2 (0.40) | PLK1CYP1A2RAB9AMAPTNPC1 | |
| SCHEMBL9757131 | 0.74 | MAOB (0.42) | CYP1A2RAB9AMAPTNPC1KDM4E | |
| SCHEMBL3619562 | 0.73 | RAB9A (0.68) | PLK1RAB9AMAPTNPC1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991019475-A2 | QUINOLINYL-BENZOHETEROBICYCLIC DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D¿4? | RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) | 1991-12-26 | — | — | WO | disclosed |