Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.47 |
| ▸ | NOD2 | Q9HC29 | 4/20 | 0.42 |
| ▸ | NOD1 | Q9Y239 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
| ▸ | F10 | P00742 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10004969 | 0.88 | NOD2 (0.54) | HRH3NOD2NOD1LMNAGAA | |
| SCHEMBL18332165 | 0.86 | NOD2 (0.44) | HRH3NOD2NOD1LMNAALOX5 | |
| SCHEMBL18331720 | 0.86 | HRH3 (0.42) | HRH3NOD2NOD1LMNAGAA | |
| SCHEMBL18332163 | 0.85 | HRH3 (0.41) | HRH3NOD2NOD1LMNAGAA | |
| SCHEMBL18332161 | 0.85 | GPR119 (0.47) | NOD2NOD1 | |
| SCHEMBL10004537 | 0.81 | HRH3 (0.41) | HRH3NOD2NOD1LMNAGAA | |
| SCHEMBL18332221 | 0.81 | HRH3 (0.39) | HRH3NOD2NOD1LMNAGAA | |
| SCHEMBL18331685 | 0.79 | NOD2 (0.44) | HRH3NOD2NOD1LMNAALOX5 | |
| SCHEMBL18332392 | 0.79 | NOD2 (0.44) | NOD2NOD1LMNAGAAALOX5 | |
| SCHEMBL10003547 | 0.79 | NOD2 (0.52) | HRH3NOD2NOD1LMNAGAA |
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-2016204261-A1 | AMINOPYRAZOLE DERIVATIVES | 中外製薬株式会社 | 2016-12-22 | — | — | WO | disclosed |