Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.39 |
| ▸ | ACKR3 | P25106 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.38 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16612752 | 0.86 | HCRTR2 (0.38) | HCRTR2HCAR3JAK2 | |
| SCHEMBL16612738 | 0.84 | HCRTR2 (0.36) | HCRTR2 | |
| SCHEMBL16612850 | 0.80 | HCRTR2 (0.38) | MAPTHCRTR2ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL16612710 | 0.77 | KDM4E (0.49) | MAPTRAB9AHCRTR2ALDH1A1LMNA | |
| SCHEMBL16612665 | 0.76 | HCRTR2 (0.39) | HCRTR2JAK2 | |
| SCHEMBL16612877 | 0.76 | HCRTR2 (0.35) | HCRTR2 | |
| SCHEMBL16612866 | 0.76 | HCRTR2 (0.41) | HCRTR2KDM4E | |
| SCHEMBL16612726 | 0.75 | ALDH1A1 (0.40) | HCRTR2ALDH1A1KDM4EHPGD | |
| SCHEMBL16612772 | 0.75 | KMT2A (0.46) | MAPTHCRTR2ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL16612690 | 0.75 | HCRTR2 (0.35) | HCRTR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2675801-B1 | NOVEL PYRAZOLE AND IMIDAZOLE DERIVATIVES USEFUL AS OREXIN ANTAGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2015-04-08 | — | — | EP | disclosed |