Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC7 | O00311 | 1/20 | 0.43 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.41 |
| ▸ | HPGD | P15428 | 7/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | FHIT | P49789 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 8/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | GRM6 | O15303 | 2/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7170630 | 0.85 | ALDH1A1 (0.52) | CDC7DBF4ALDH1A1HPGDKMT2A | |
| SCHEMBL7510244 | 0.84 | ALDH1A1 (0.47) | CDC7DBF4ALDH1A1HPGDFHIT | |
| SCHEMBL5130348 | 0.81 | HPGD (0.46) | ALDH1A1HPGDKDM4ECYP1A2POLB | |
| SCHEMBL7175525 | 0.74 | ALDH1A1 (0.52) | CDC7DBF4ALDH1A1HPGDKMT2A | |
| SCHEMBL7515109 | 0.73 | ALDH1A1 (0.47) | CDC7DBF4ALDH1A1HPGDFHIT | |
| SCHEMBL5115392 | 0.72 | NPC1 (0.46) | CDC7DBF4ALDH1A1HPGDKDM4E | |
| SCHEMBL1622309 | 0.70 | FHIT (0.77) | ALDH1A1HPGDKMT2AMEN1FHIT | |
| SCHEMBL5809142 | 0.68 | SMN1; SMN2 (0.40) | ALDH1A1HPGDKMT2AMEN1GAA | |
| SCHEMBL5814772 | 0.67 | ADORA2A (0.48) | ALDH1A1HPGDGAAKDM4EPOLB | |
| SCHEMBL7013488 | 0.66 | ALDH1A1 (0.55) | CDC7DBF4ALDH1A1HPGDKMT2A |
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 |