Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 17/20 | 0.45 |
| ▸ | TCF7L2 | Q9NQB0 | 17/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | SLC26A6 | Q9BXS9 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7016962 | 0.92 | ESR1 (0.41) | CTNNB1TCF7L2ESR1SLC26A6 | |
| SCHEMBL7013793 | 0.91 | CTNNB1 (0.45) | CTNNB1TCF7L2ESR1 | |
| SCHEMBL8178648 | 0.89 | CTNNB1 (0.46) | CTNNB1TCF7L2ESR1SLC26A6KDM4E | |
| SCHEMBL7012518 | 0.89 | ESR1 (0.42) | CTNNB1TCF7L2ESR1KDM4EALDH1A1 | |
| SCHEMBL7016510 | 0.88 | TP53 (0.40) | CTNNB1TCF7L2ESR1KDM4EALDH1A1 | |
| SCHEMBL7013347 | 0.87 | PDE4A (0.42) | CTNNB1TCF7L2ESR1KDM4EALDH1A1 | |
| SCHEMBL7020092 | 0.87 | PDE4A (0.48) | CTNNB1TCF7L2KDM4EALDH1A1HPGD | |
| SCHEMBL7017513 | 0.87 | KDM4E (0.48) | CTNNB1TCF7L2SLC26A6KDM4EALDH1A1 | |
| SCHEMBL7018914 | 0.86 | PDE5A (0.46) | — | |
| SCHEMBL7022055 | 0.85 | SMN1; SMN2 (0.49) | CTNNB1TCF7L2KDM4EALDH1A1CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0934321-B1 | THIENOPYRIMIDINE WITH PHOSPHODIESTERASE V INHIBITING EFFECT | MERCK PATENT GMBH (DE) | 2003-08-06 | — | — | EP | disclosed |
| EP-0934321-A1 | THIENOPYRIMIDINE WITH PHOSPHODIESTERASE V INHIBITING EFFECT | MERCK PATENT GmbH (DE) | 1999-08-11 | — | — | EP | disclosed |
| WO-1998017668-A1 | THIENOPYRIMIDINE WITH PHOSPHODIESTERASE V INHIBITING EFFECT | MERCK PATENT GMBH (DE) | 1998-04-30 | — | — | WO | disclosed |