Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 5/20 | 0.64 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.45 |
| ▸ | HCRTR1 | O43613 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.37 |
| ▸ | GSR | P00390 | 1/20 | 0.36 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP8 | P22894 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7706361 | 0.85 | HCRTR2 (0.62) | HCRTR2HCRTR1ALDH1A1MAPTKDM4E | |
| SCHEMBL7709292 | 0.79 | HCRTR2 (1.00) | HCRTR2HCRTR1ALDH1A1MAPTKMT2A | |
| SCHEMBL7708524 | 0.78 | HCRTR2 (0.74) | HCRTR2HCRTR1LMNAPOLB | |
| SCHEMBL2594821 | 0.76 | HCRTR2 (0.50) | HCRTR2HCRTR1ALDH1A1MAPTKDM4E | |
| SCHEMBL12480878 | 0.71 | KMT2A (0.47) | HCRTR2PTGDR2ALDH1A1MAPTKDM4E | |
| SCHEMBL2585096 | 0.71 | HCRTR2 (0.74) | HCRTR2PTGDR2HCRTR1ALDH1A1MAPT | |
| SCHEMBL15485100 | 0.70 | KMT2A (0.43) | HCRTR2PTGDR2ALDH1A1MAPTKDM4E | |
| SCHEMBL31214657 | 0.68 | KDM4E (0.55) | PTGDR2ALDH1A1MAPTKDM4EMEN1 | |
| SCHEMBL7708626 | 0.66 | HCRTR1 (0.71) | HCRTR2PTGDR2HCRTR1ALDH1A1MAPT | |
| SCHEMBL31282458 | 0.64 | ALDH1A1 (0.45) | PTGDR2ALDH1A1MAPTKDM4EMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011138266-A1 | INDOLIZINE AND IMIDAZOPYRIDINE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS | EVOTEC AG (DE) | 2011-11-10 | — | — | WO | disclosed |
| WO-2011138266-A1 | INDOLIZINE AND IMIDAZOPYRIDINE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS | EVOTEC AG (DE) | 2011-11-10 | — | — | WO | disclosed |