Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 4/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.32 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | STAT3 | P40763 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11056353 | 0.89 | HCAR2 (0.34) | ALDH1A1MEN1KMT2ACRHR1HCAR2 | |
| SCHEMBL11055462 | 0.89 | HCAR2 (0.35) | ALDH1A1C5AR1BCHECRHR1HCAR2 | |
| SCHEMBL11059465 | 0.83 | KMT2A (0.37) | MEN1KMT2ACRHR1HCAR2MAOA | |
| SCHEMBL11053513 | 0.82 | MAPK14 (0.39) | ALDH1A1MEN1KMT2AHCAR2HPGD | |
| SCHEMBL11056509 | 0.81 | GRM1 (0.34) | ALDH1A1KMT2AESR1ESR2LMNA | |
| SCHEMBL11059482 | 0.78 | HCAR2 (0.37) | ALDH1A1KMT2ACRHR1HCAR2LMNA | |
| SCHEMBL11057683 | 0.74 | MAPK14 (0.34) | MEN1KMT2ASTAT3HTTSMN1; SMN2 | |
| SCHEMBL11059306 | 0.74 | CHRNA7 (0.45) | ALDH1A1HPGDMAPK14 | |
| SCHEMBL11060192 | 0.73 | MKNK1 (0.36) | ALDH1A1MEN1KMT2ACRHR1HTT | |
| SCHEMBL11056312 | 0.73 | LCK (0.44) | ALDH1A1MEN1KMT2ALMNAGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-4452980-A | DIARRHEA | WILLIAM H. RORER, INC. (US) | 1984-06-05 | — | — | US | disclosed |
| US-4246409-A | ANTIDIARRHEAL AGENTS | WILLIAM H. RORER, INC. (US) | 1981-01-20 | — | — | US | disclosed |
| US-4225315-A | Triazinones from amidinoureas | WILLIAM H. RORER, INC. (US) | 1980-09-30 | — | — | US | disclosed |