Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | BCL9 | O00512 | 1/20 | 0.43 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20625250 | 0.90 | GAA (0.51) | GAABCL9CTNNB1MAPTALDH1A1 | |
| SCHEMBL2803614 | 0.87 | CYP1A2 (0.49) | GAABCL9CTNNB1MAPTALDH1A1 | |
| SCHEMBL2722317 | 0.87 | CYP1A2 (0.49) | GAABCL9CTNNB1MAPTALDH1A1 | |
| SCHEMBL1560458 | 0.86 | CYP1A2 (0.51) | GAABCL9CTNNB1MAPTALDH1A1 | |
| SCHEMBL3285385 | 0.86 | CYP1A2 (0.51) | GAABCL9CTNNB1MAPTALDH1A1 | |
| SCHEMBL18505913 | 0.86 | GAA (0.48) | GAABCL9CTNNB1MAPTALDH1A1 | |
| SCHEMBL1092866 | 0.83 | GAA (0.46) | GAABCL9CTNNB1MAPTALDH1A1 | |
| SCHEMBL7419204 | 0.83 | GAA (0.46) | GAABCL9CTNNB1MAPTALDH1A1 | |
| SCHEMBL313843 | 0.81 | MAPT (0.48) | GAABCL9CTNNB1MAPTALDH1A1 | |
| SCHEMBL15299584 | 0.81 | CYP1A2 (0.44) | GAABCL9CTNNB1MAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101044123-B | Pyrimidine derivatives condensed with non-aromatic rings | ASTELLAS PHARMA INC | 2010-09-08 | — | — | CN | disclosed |
| CN-101044123-A | Pyrimidine derivatives condensed with non-aromatic rings | ASTELLAS PHARMA INC (JP) | 2007-09-26 | — | — | CN | disclosed |