Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL6992507 | 0.86 | ALDH1A1 (0.45) | ALDH1A1HTTKDM4EKCNH2SMN1; SMN2 | |
| SCHEMBL7495346 | 0.84 | ALDH1A1 (0.43) | ALDH1A1HTTKDM4EKCNH2SMN1; SMN2 | |
| SCHEMBL7947370 | 0.83 | ALDH1A1 (0.45) | ALDH1A1HTTKDM4EKCNH2SMN1; SMN2 | |
| SCHEMBL6996096 | 0.82 | ALDH1A1 (0.44) | ALDH1A1HTTKDM4EKCNH2SMN1; SMN2 | |
| SCHEMBL6996780 | 0.82 | ALDH1A1 (0.44) | ALDH1A1HTTKDM4EKCNH2SMN1; SMN2 | |
| SCHEMBL6997482 | 0.81 | ALDH1A1 (0.42) | ALDH1A1HTTKDM4EKCNH2SMN1; SMN2 | |
| SCHEMBL7956188 | 0.80 | ALDH1A1 (0.38) | ALDH1A1HTTKDM4EKCNH2SMN1; SMN2 | |
| SCHEMBL7002664 | 0.80 | HRH1 (0.40) | ALDH1A1HTTKDM4EKCNH2SMN1; SMN2 | |
| SCHEMBL6993974 | 0.79 | HRH1 (0.40) | ALDH1A1HTTKDM4EKCNH2SMN1; SMN2 | |
| SCHEMBL6993981 | 0.78 | KCNH2 (0.37) | ALDH1A1HTTKDM4EKCNH2SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6211199-B1 | HISTAMINE AND TACHYKININ RECEPTOR ANTAGONISTS; ANTIASTHMATICS, ANTIEMETICS; RESPIRATORY SYSTEM DISORDERS, INFLAMMATORY BOWEL DISEASE, CONJUNCTIVITIS | AVENTIS PHARMACEUTICALS INC. | 2001-04-03 | — | — | US | disclosed |