Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PDE5A | O76074 | 6/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | PGK1 | P00558 | 2/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.42 |
| ▸ | USP2 | O75604 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5130031 | 0.90 | SMN1; SMN2 (0.46) | ALDH1A1HPGDSMN1; SMN2PDE5AMAPT | |
| SCHEMBL7016466 | 0.87 | PDE5A (0.51) | ALDH1A1HPGDSMN1; SMN2PDE5AMAPT | |
| SCHEMBL5813077 | 0.87 | ALDH1A1 (0.48) | ALDH1A1HPGDSMN1; SMN2PDE5AMAPT | |
| SCHEMBL5127640 | 0.86 | PDE5A (0.46) | ALDH1A1HPGDSMN1; SMN2PDE5AMAPT | |
| SCHEMBL7008203 | 0.85 | KDM4E (0.48) | ALDH1A1PDE5AMAPTCLK4USP2 | |
| SCHEMBL7015318 | 0.85 | ALDH1A1 (0.48) | ALDH1A1HPGDSMN1; SMN2PDE5AMAPT | |
| SCHEMBL7017308 | 0.85 | PRKCI (0.50) | ALDH1A1HPGDSMN1; SMN2PDE5AMAPT | |
| SCHEMBL5122543 | 0.85 | ALDH1A1 (0.52) | ALDH1A1HPGDSMN1; SMN2PDE5AMAPT | |
| SCHEMBL5121765 | 0.84 | PRKCI (0.57) | ALDH1A1PDE5ALMNAMEN1KMT2A | |
| SCHEMBL7010996 | 0.84 | KDM4E (0.42) | ALDH1A1PDE5AMAPTPGK1KDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1329454-A1 | THIENOPYRIMIDINE COMPOUNDS AND THEIR SALTS AND PROCESS FOR PREPARATION OF BOTH | NIPPON SODA CO., LTD. (JP) | 2003-07-23 | — | — | EP | disclosed |