Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR1 | Q9BXC0 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.33 |
| ▸ | CASP1 | P29466 | 5/20 | 0.33 |
| ▸ | CASP7 | P55210 | 5/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MAT2A | P31153 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | DYRK1A | Q13627 | 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 | |
|---|---|---|---|---|
| SCHEMBL11056926 | 0.90 | HCAR1 (0.46) | HCAR1ALDH1A1CYP1A2CASP1CASP7 | |
| Hydrochloric Acid SCHEMBL11056262 | 0.89 | HCAR1 (0.44) | HCAR1ALDH1A1CYP1A2CASP1CASP7 | |
| SCHEMBL11055971 | 0.88 | HCAR1 (0.36) | HCAR1CYP1A2MAT2ACHRNA7 | |
| SCHEMBL11059289 | 0.87 | HCAR1 (0.36) | HCAR1CHRNA7 | |
| SCHEMBL11060207 | 0.84 | HCAR1 (0.38) | HCAR1ALDH1A1CYP1A2CASP1CASP7 | |
| SCHEMBL11056476 | 0.81 | HCAR1 (0.40) | HCAR1ALDH1A1CYP3A4KMT2ACYP2C9 | |
| SCHEMBL11057683 | 0.80 | MAPK14 (0.34) | HCAR1CYP1A2MAPK1MEN1KMT2A | |
| SCHEMBL10541722 | 0.79 | HCAR1 (0.43) | HCAR1ALDH1A1MEN1KMT2ACHRNA7 | |
| SCHEMBL11054879 | 0.78 | HCAR1 (0.38) | HCAR1CHRNA7PDE7AWEE1 | |
| SCHEMBL11052478 | 0.78 | TDP2 (0.33) | ALDH1A1CYP1A2CASP1CASP7HSD17B10 |
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 |