Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | FEN1 | P39748 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8212722 | 0.85 | CHRM2 (0.41) | ALDH1A1THRBSMN1; SMN2CHRM2CHRM4 | |
| SCHEMBL8207932 | 0.82 | CHRM2 (0.39) | ALDH1A1THRBSMN1; SMN2CHRM2CHRM4 | |
| SCHEMBL27969681 | 0.77 | CHRM2 (0.44) | ALDH1A1THRBSMN1; SMN2CHRM2CHRM4 | |
| SCHEMBL27882300 | 0.76 | ALDH1A1 (0.51) | ALDH1A1THRBSMN1; SMN2CHRM2CHRM4 | |
| SCHEMBL28220196 | 0.76 | ALDH1A1 (0.51) | ALDH1A1THRBSMN1; SMN2CHRM2CHRM4 | |
| Hydrochloric Acid SCHEMBL28203554 | 0.75 | ALDH1A1 (0.41) | ALDH1A1THRBSMN1; SMN2CHRM2CHRM4 | |
| SCHEMBL3949129 | 0.74 | ALDH1A1 (0.40) | ALDH1A1THRBSMN1; SMN2CHRM2CHRM4 | |
| SCHEMBL3950829 | 0.74 | ALDH1A1 (0.40) | ALDH1A1THRBSMN1; SMN2CHRM2CHRM4 | |
| SCHEMBL3949967 | 0.74 | ALDH1A1 (0.40) | ALDH1A1THRBSMN1; SMN2CHRM2CHRM4 | |
| SCHEMBL322281 | 0.74 | CHRM2 (0.44) | ALDH1A1THRBSMN1; SMN2CHRM2CHRM4 |
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-1019501-A1 | NOVEL PYRIMIDINE DERIVATIVE | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2000-07-19 | — | — | EP | disclosed |
| WO-1998041526-A1 | NOVEL PYRIMIDINE DERIVATIVE | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1998-09-24 | — | — | WO | disclosed |