Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | BRD4 | O60885 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | DGKA | P23743 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6176470 | 0.85 | TSHR (0.42) | ALDH1A1TSHRMAPTLMNAMAPK1 | |
| SCHEMBL6176995 | 0.83 | TSHR (0.40) | ALDH1A1TSHRMAPTLMNAMAPK1 | |
| SCHEMBL7959563 | 0.82 | HTT (0.37) | HTTBRD4ALDH1A1ATMTSHR | |
| SCHEMBL6177988 | 0.82 | ADORA3 (0.41) | ALDH1A1TSHRMAPTLMNATP53 | |
| SCHEMBL6176322 | 0.82 | TSHR (0.43) | HTTALDH1A1TSHRMAPTLMNA | |
| SCHEMBL7958957 | 0.82 | CTNNB1 (0.42) | ALDH1A1TSHRMAPTLMNASMN1; SMN2 | |
| SCHEMBL7950890 | 0.81 | HTT (0.38) | HTTBRD4ALDH1A1ATMTSHR | |
| SCHEMBL6177133 | 0.81 | TSHR (0.41) | ALDH1A1TSHRMAPTLMNAMAPK1 | |
| SCHEMBL7964984 | 0.81 | TSHR (0.39) | ALDH1A1TSHRMAPTLMNATP53 | |
| SCHEMBL7959036 | 0.80 | TSHR (0.38) | BRD4ALDH1A1TSHRMAPTLMNA |
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-6239131-B1 | WHICH HAVE GASTRIN AND/OR CCK-B (CHOLECYSTOKININ-B) RECEPTOR ANTAGONISM, USEFUL AS REMEDIES FOR GASTRIC ULCER AND GASTROINTESTINAL MOVEMENT DISORDER. | ZERIA PHARMACEUTICAL CO., LTD. (JP) | 2001-05-29 | — | — | US | disclosed |