Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | OXTR | P30559 | 4/20 | 0.39 |
| ▸ | AVPR1A | P37288 | 4/20 | 0.39 |
| ▸ | CACNA1B | Q00975 | 4/20 | 0.39 |
| ▸ | CACNA1H | O95180 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7673018 | 0.99 | HTR2A (0.39) | HTR2AHTR2CSLC6A4OXTRAVPR1A | |
| SCHEMBL7672815 | 0.95 | OXTR (0.42) | OXTRAVPR1ACACNA1BCACNA1HSMN1; SMN2 | |
| SCHEMBL7671754 | 0.92 | NPC1 (0.43) | OXTRAVPR1ACACNA1BCACNA1HSMN1; SMN2 | |
| SCHEMBL7665766 | 0.91 | ALDH1A1 (0.46) | OXTRAVPR1ASMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL7670754 | 0.91 | SMN1; SMN2 (0.42) | OXTRAVPR1ACACNA1BCACNA1HSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7670137 | 0.91 | OXTR (0.41) | OXTRAVPR1ACACNA1BCACNA1HSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7671744 | 0.91 | NPC1 (0.43) | OXTRAVPR1ACACNA1BCACNA1HSMN1; SMN2 | |
| Phosphoric Acid SCHEMBL7665536 | 0.91 | OXTR (0.41) | OXTRAVPR1ACACNA1BCACNA1HSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7663029 | 0.91 | SMN1; SMN2 (0.42) | OXTRAVPR1ACACNA1BCACNA1HSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7665755 | 0.91 | ALDH1A1 (0.45) | OXTRAVPR1ASMN1; SMN2ALDH1A1MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6403607-B1 | ANTIULCER | Hidaka, Hiroyoshi (JP) | 2002-06-11 | — | — | US | disclosed |
| EP-1072587-A1 | SULFONAMIDE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT | Hidaka, Hiroyoshi (JP) | 2001-01-31 | — | — | EP | disclosed |