Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | GABRR1 | P24046 | 3/20 | 0.33 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.33 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9054773 | 0.87 | GABRR1 (0.39) | TSHRCYP1A2GABRR1GABBR2GABBR1 | |
| SCHEMBL7530841 | 0.87 | GABRR1 (0.39) | TSHRCYP1A2GABRR1GABBR2GABBR1 | |
| SCHEMBL17677168 | 0.77 | TSHR (0.35) | TSHRCYP1A2GABRR1GABBR2GABBR1 | |
| SCHEMBL17512352 | 0.77 | TSHR (0.40) | GAAMEN1KMT2AATMSMN1; SMN2 | |
| SCHEMBL20683017 | 0.77 | TSHR (0.40) | GAAMEN1KMT2AATMSMN1; SMN2 | |
| SCHEMBL7718222 | 0.77 | TSHR (0.39) | TSHRGABRR1GABBR2GABBR1LMNA | |
| SCHEMBL689113 | 0.77 | TSHR (0.39) | TSHRGABRR1GABBR2GABBR1LMNA | |
| Methylamine SCHEMBL6867533 | 0.74 | MAPK1 (0.48) | GAAKMT2ATSHRCYP1A2MAPK1 | |
| SCHEMBL65000 | 0.74 | CYP1A2 (0.53) | GAAMEN1KMT2AATMSMN1; SMN2 | |
| SCHEMBL579540 | 0.73 | ALDH1A1 (0.35) | TSHRCYP1A2MAPK1ALDH1A1CYP2C9 |
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-5922703-A | USEFUL FOR TREATING CONGESTIVE HEART FAILURE | THE PROCTER & GAMBLE COMPANY (US) | 1999-07-13 | — | — | US | disclosed |
| EP-0720617-A1 | NOVEL URETHANE-CONTAINING AMINOSTEROID COMPOUNDS | THE PROCTER & GAMBLE COMPANY (US) | 1996-07-10 | — | — | EP | disclosed |
| WO-1995008559-A1 | NOVEL URETHANE-CONTAINING AMINOSTEROID COMPOUNDS | THE PROCTER & GAMBLE COMPANY (US) | 1995-03-30 | — | — | WO | disclosed |