Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | HPGD | P15428 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | PRKCI | P41743 | 3/20 | 0.45 |
| ▸ | CDC7 | O00311 | 5/20 | 0.43 |
| ▸ | DBF4 | Q9UBU7 | 5/20 | 0.43 |
| ▸ | GRM6 | O15303 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | FHIT | P49789 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7170630 | 0.89 | ALDH1A1 (0.52) | ALDH1A1HPGDHSD17B10MAPTKDM4E | |
| SCHEMBL7515109 | 0.89 | ALDH1A1 (0.47) | ALDH1A1HPGDHSD17B10MAPTKDM4E | |
| SCHEMBL5815696 | 0.84 | CDC7 (0.43) | ALDH1A1HPGDHSD17B10MAPTKDM4E | |
| SCHEMBL5119506 | 0.80 | PRKCI (0.57) | ALDH1A1HPGDMAPTKDM4EPRKCI | |
| SCHEMBL7175525 | 0.78 | ALDH1A1 (0.52) | ALDH1A1HPGDHSD17B10MAPTKDM4E | |
| SCHEMBL8179296 | 0.72 | KDM4E (0.49) | ALDH1A1HPGDHSD17B10MAPTKDM4E | |
| SCHEMBL1622309 | 0.72 | FHIT (0.77) | ALDH1A1HPGDHSD17B10MAPTKDM4E | |
| SCHEMBL8336385 | 0.71 | ALDH1A1 (0.45) | ALDH1A1HPGDMAPTKDM4EPRKCI | |
| SCHEMBL7013488 | 0.70 | ALDH1A1 (0.55) | ALDH1A1HPGDMAPTKDM4ECDC7 | |
| SCHEMBL5124102 | 0.70 | ALDH1A1 (0.52) | ALDH1A1HPGDMAPTKDM4EPRKCI |
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-0920431-A1 | THIENOPYRIMIDINES | MERCK PATENT GmbH (DE) | 1999-06-09 | — | — | EP | disclosed |
| WO-1998006722-A1 | THIENOPYRIMIDINES | MERCK PATENT GMBH (DE) | 1998-02-19 | — | — | WO | disclosed |