Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.65 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 7/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 7/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.51 |
| ▸ | TSHR | P16473 | 5/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | CLK4 | Q9HAZ1 | 7/20 | 0.51 |
| ▸ | PDE5A | O76074 | 3/20 | 0.45 |
| ▸ | GBA1 | P04062 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5118095 | 0.97 | MAPT (0.69) | MAPTNPSR1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5815249 | 0.95 | MAPT (0.58) | MAPTNPSR1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7514104 | 0.92 | MAPT (0.54) | MAPTNPSR1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5129049 | 0.91 | MAPT (0.61) | MAPTNPSR1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5125323 | 0.88 | MAPT (0.57) | MAPTNPSR1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7507644 | 0.87 | MAPT (0.56) | MAPTNPSR1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7520141 | 0.86 | MAPT (0.47) | MAPTNPSR1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5123309 | 0.86 | MAPT (0.69) | MAPTNPSR1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5808881 | 0.86 | MAPT (0.56) | MAPTNPSR1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5130013 | 0.86 | MAPT (0.53) | MAPTNPSR1CYP1A2CYP3A4CYP2D6 |
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 |