Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 2/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.37 |
| ▸ | MELK | Q14680 | 1/20 | 0.37 |
| ▸ | STK24 | Q9Y6E0 | 1/20 | 0.37 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.34 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | REN | P00797 | 2/20 | 0.32 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.31 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
| ▸ | NR3C2 | P08235 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL398827 | 0.79 | AHR (0.56) | AHRJAK2RPS6KA3MELKSTK24 | |
| SCHEMBL29467533 | 0.79 | AHR (0.56) | AHRJAK2RPS6KA3MELKSTK24 | |
| SCHEMBL29549836 | 0.79 | MAPT (0.54) | MEN1KMT2AMAPTNPSR1APOBEC3G | |
| SCHEMBL2197151 | 0.79 | MAPT (0.54) | MEN1KMT2AMAPTNPSR1APOBEC3G | |
| SCHEMBL398169 | 0.79 | MAPT (0.54) | MEN1KMT2AMAPTNPSR1APOBEC3G | |
| Hydrochloric Acid SCHEMBL15536131 | 0.77 | AHR (0.54) | AHRJAK2RPS6KA3MELKSTK24 | |
| Quinoline SCHEMBL27846294 | 0.67 | ALDH1A1 (0.53) | AHRJAK2RPS6KA3MELKSTK24 | |
| Ethoxycarbonyl Group SCHEMBL27784658 | 0.65 | JAK2 (0.41) | AHRJAK2RPS6KA3MELKSTK24 | |
| SCHEMBL22288142 | 0.64 | ALDH1A1 (0.40) | MEN1KMT2AMAPTKEAP1CYP3A4 | |
| SCHEMBL7006953 | 0.64 | MAPT (0.50) | MEN1KMT2AMAPTNPSR1APOBEC3G |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2509954-A1 | 4 -OXO- 1H -QUINOLINE- 3 - CARBOXAMIDES AS MODULATORS OF ATP -BINDING CASSETTE TRANSPORTERS | Vertex Pharmaceuticals Incorporated (US) | 2012-10-17 | — | — | EP | disclosed |
| WO-2011072241-A1 | 4 -OXO- IH -QUINOLINE- 3 - CARBOXAMIDES AS MODULATORS OF ATP -BINDING CASSETTE TRANSPORTERS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-06-16 | — | — | WO | disclosed |