Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR2 | P50052 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CASP6 | P55212 | 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 | |
|---|---|---|---|---|
| SCHEMBL7660230 | 1.00 | AGTR2 (0.39) | AGTR2CHRNB2CHRNA4SMN1; SMN2ALDH1A1 | |
| SCHEMBL888516 | 0.86 | CHRNB2 (0.38) | CHRNB2CHRNA4SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL888515 | 0.86 | CHRNB2 (0.38) | CHRNB2CHRNA4SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL7670556 | 0.85 | MMP2 (0.34) | ALDH1A1MAPTHTT | |
| SCHEMBL7662760 | 0.85 | SMN1; SMN2 (0.37) | AGTR2CHRNB2CHRNA4SMN1; SMN2ALDH1A1 | |
| SCHEMBL7660296 | 0.84 | CHRNB2 (0.36) | CHRNB2CHRNA4SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL7753165 | 0.84 | CHRNB2 (0.41) | CHRNB2CHRNA4SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL7672435 | 0.84 | CHRNB2 (0.41) | CHRNB2CHRNA4SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL7752527 | 0.82 | CHRNB2 (0.40) | CHRNB2CHRNA4SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL7660053 | 0.82 | CHRNB2 (0.40) | CHRNB2CHRNA4SMN1; SMN2ALDH1A1MAPT |
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-0366085-B1 | Tetrahydropyrimidines, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1996-04-17 | — | — | EP | disclosed |
| EP-0366085-A2 | Tetrahydropyrimidines, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1990-05-02 | — | — | EP | disclosed |