Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 2/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | THRA | P10827 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ELANE | P08246 | 2/20 | 0.39 |
| ▸ | CTSG | P08311 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 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 | |
|---|---|---|---|---|
| SCHEMBL1836879 | 0.85 | THRA (0.57) | PPARAALOX5PTGS2PPARGTHRA | |
| SCHEMBL1838611 | 0.84 | PPARA (0.48) | PPARAALOX5PTGS2PPARGTHRA | |
| SCHEMBL9905375 | 0.82 | NCEH1 (0.40) | PPARAALOX5THRATHRBKDM4E | |
| SCHEMBL1836159 | 0.81 | THRA (0.63) | PPARAALOX5PTGS2PPARGTHRA | |
| SCHEMBL1836474 | 0.80 | PPARA (0.53) | PPARAALOX5PTGS2PPARGTHRA | |
| SCHEMBL1836108 | 0.79 | THRA (0.66) | PPARAALOX5PTGS2PPARGTHRA | |
| SCHEMBL1836935 | 0.79 | THRA (0.66) | PPARAALOX5PTGS2PPARGTHRA | |
| SCHEMBL1835055 | 0.79 | THRA (0.66) | PPARAALOX5PTGS2PPARGTHRA | |
| SCHEMBL1841440 | 0.79 | THRA (0.66) | PPARAALOX5PTGS2PPARGTHRA | |
| SCHEMBL1837530 | 0.79 | THRA (0.66) | PPARAALOX5PTGS2PPARGTHRA |
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 |