Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.54 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.54 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.54 |
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2930549 | 0.81 | SIGMAR1 (0.67) | SIGMAR1CHRM5CHRM3CA12CA1 | |
| SCHEMBL3946289 | 0.78 | CA12 (0.58) | SIGMAR1CHRM5CHRM3CA12CA1 | |
| SCHEMBL3946291 | 0.78 | SIGMAR1 (0.77) | SIGMAR1CHRM5CHRM3CA12CA1 | |
| SCHEMBL1901358 | 0.78 | SIGMAR1 (0.84) | SIGMAR1CHRM5CHRM3CA12CA1 | |
| SCHEMBL7446957 | 0.76 | SIGMAR1 (0.53) | SIGMAR1CHRM5CHRM3CA12CA1 | |
| SCHEMBL1379768 | 0.76 | ALDH1A1 (0.41) | CHRM5CHRM3ALDH1A1LMNATSHR | |
| SCHEMBL6479844 | 0.76 | SIGMAR1 (0.75) | SIGMAR1CHRM5CHRM3CA12CA1 | |
| SCHEMBL16708775 | 0.75 | SIGMAR1 (0.54) | SIGMAR1CHRM5CHRM3CA12CA1 | |
| SCHEMBL29956260 | 0.75 | SIGMAR1 (0.51) | SIGMAR1CHRM5CHRM3CA12CA1 | |
| SCHEMBL14174994 | 0.75 | SIGMAR1 (0.59) | SIGMAR1CHRM5CHRM3CA12CA1 |
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-2004108068-A2 | 4-[4-(4-MORPHOLINO)ANILINO]PYRIMIDINE DERIVATIVES, METHOD FOR PREPARING THEREOF AND ANTIVIRAL PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | B & C BIOPHARM CO., LTD. (KR) | 2004-12-16 | — | — | WO | claimed |