Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | PIP4K2C | Q8TBX8 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL2369471 | 0.90 | ALDH1A1 (0.47) | ALDH1A1KDM4ESMN1; SMN2CYP2C9HPGD | |
| SCHEMBL3385335 | 0.85 | TNF (0.48) | ALDH1A1KDM4ESMN1; SMN2CYP2C9HPGD | |
| SCHEMBL2368361 | 0.79 | TNF (0.56) | ALDH1A1SMN1; SMN2PIP4K2CLMNAMAPT | |
| SCHEMBL2368702 | 0.78 | LMNA (0.40) | ALDH1A1KDM4ESMN1; SMN2CYP2C9HPGD | |
| SCHEMBL3381310 | 0.76 | ALDH1A1 (0.47) | ALDH1A1KDM4ESMN1; SMN2CYP2C9HPGD | |
| SCHEMBL2369261 | 0.75 | SMN1; SMN2 (0.43) | ALDH1A1KDM4ESMN1; SMN2HPGDNPSR1 | |
| SCHEMBL3387429 | 0.75 | ALDH1A1 (0.51) | ALDH1A1KDM4ESMN1; SMN2CYP2C9HPGD | |
| SCHEMBL2369286 | 0.75 | PRKCZ (0.37) | ALDH1A1KDM4ESMN1; SMN2CYP2C9HPGD | |
| SCHEMBL2368714 | 0.74 | ESR1 (0.40) | ALDH1A1SMN1; SMN2HPGDMEN1KMT2A | |
| SCHEMBL2369038 | 0.73 | ALDH1A1 (0.59) | ALDH1A1KDM4ESMN1; SMN2HPGDMEN1 |
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-1641803-A1 | THIENOPYRIMIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS | Xention Discovery Limited (GB) | 2006-04-05 | — | — | EP | disclosed |
| WO-2004111057-A1 | THIENOPYRIMIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS | XENTION DISCOVERY LIMITED (GB) | 2004-12-23 | — | — | WO | disclosed |