Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 8/20 | 0.51 |
| ▸ | SLC16A3 | O15427 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CCKAR | P32238 | 2/20 | 0.45 |
| ▸ | CCKBR | P32239 | 2/20 | 0.45 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5265874 | 0.91 | SLC16A3 (0.48) | SLC16A3ALDH1A1CCKBRKCNA5TSHR | |
| SCHEMBL5270886 | 0.87 | SMN1; SMN2 (0.57) | RAB9ASLC16A3SMN1; SMN2ALDH1A1CCKAR | |
| SCHEMBL5269177 | 0.84 | RAB9A (0.56) | RAB9ANPC1SMN1; SMN2ALDH1A1GAA | |
| SCHEMBL5273547 | 0.82 | TSHR (0.49) | SLC16A3ALDH1A1KCNA5TSHRMEN1 | |
| SCHEMBL5269255 | 0.82 | RAB9A (0.51) | RAB9ASLC16A3NPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL5269930 | 0.82 | KCNA5 (0.47) | SLC16A3ALDH1A1KCNA5TSHRMEN1 | |
| SCHEMBL5269683 | 0.82 | RAB9A (0.51) | RAB9ANPC1SMN1; SMN2ALDH1A1GAA | |
| SCHEMBL5265198 | 0.81 | RAB9A (0.55) | RAB9ANPC1SMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL5268776 | 0.80 | CCKAR (0.52) | RAB9ASLC16A3NPC1SMN1; SMN2CCKAR | |
| SCHEMBL5270919 | 0.80 | KCNA5 (0.51) | SLC16A3SMN1; SMN2ALDH1A1KCNA5TSHR |
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-1847531-A1 | PYRAZOLE COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2007-10-24 | — | — | EP | disclosed |