Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM4 | P08173 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5782416 | 0.89 | GAA (0.48) | CHRM4SMN1; SMN2NPSR1KDM4EALDH1A1 | |
| SCHEMBL5781267 | 0.88 | CLK4 (0.37) | CHRM4SMN1; SMN2NPSR1GAARXFP1 | |
| SCHEMBL5123345 | 0.84 | ESR1 (0.51) | CHRM4SMN1; SMN2NPSR1KDM4EALDH1A1 | |
| SCHEMBL5776821 | 0.84 | CHRM4 (0.44) | CHRM4SMN1; SMN2NPSR1KDM4EALDH1A1 | |
| SCHEMBL5115062 | 0.81 | PRKCI (0.53) | CHRM4KDM4EALDH1A1PTGS2KMT2A | |
| SCHEMBL7170030 | 0.81 | ESR1 (0.47) | CHRM4SMN1; SMN2NPSR1KDM4EALDH1A1 | |
| SCHEMBL5129063 | 0.80 | MEN1 (0.47) | KMT2AMEN1 | |
| SCHEMBL5121551 | 0.80 | KDM4E (0.44) | CHRM4SMN1; SMN2NPSR1KDM4EALDH1A1 | |
| SCHEMBL5126310 | 0.79 | CHRM4 (0.41) | CHRM4SMN1; SMN2NPSR1KDM4EALDH1A1 | |
| SCHEMBL8185543 | 0.78 | KDM4E (0.47) | SMN1; SMN2NPSR1KDM4EALDH1A1HPGD |
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-1685136-A1 | USE OF THIENOPYRIMIDINES | MERCK PATENT GmbH (DE) | 2006-08-02 | — | — | EP | disclosed |
| WO-2005047292-A1 | USE OF THIENOPYRIMIDINES | MERCK PATENT GMBH (DE) | 2005-05-26 | — | — | WO | disclosed |