Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.56 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.56 |
| ▸ | MC4R | P32245 | 1/20 | 0.56 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.56 |
| ▸ | MC3R | P41968 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.48 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.48 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19352346 | 0.79 | KDM4E (0.52) | TSHRADORA3MC4RADRA1AMC3R | |
| SCHEMBL565773 | 0.77 | ADORA3 (0.58) | TSHRADORA3MC4RADRA1AMC3R | |
| SCHEMBL28344838 | 0.77 | TSHR (0.62) | TSHRADORA3MC4RADRA1AMC3R | |
| SCHEMBL18770222 | 0.76 | KDM4E (0.46) | TSHRADORA3MC4RADRA1AMC3R | |
| SCHEMBL11205929 | 0.76 | KDM4E (0.59) | TSHRADORA3MC4RADRA1AMC3R | |
| SCHEMBL5673163 | 0.76 | CES2 (0.50) | KDM4ENAPRTPOLBKMT2AALDH1A1 | |
| SCHEMBL709377 | 0.76 | ADORA3 (0.56) | TSHRADORA3MC4RADRA1AMC3R | |
| SCHEMBL4699799 | 0.76 | KDM4E (0.48) | TSHRADORA3MC4RADRA1AMC3R | |
| SCHEMBL108950 | 0.76 | KDM4E (0.57) | TSHRADORA3MC4RADRA1AMC3R | |
| SCHEMBL29651938 | 0.76 | KDM4E (0.57) | TSHRADORA3MC4RADRA1AMC3R |
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-4145551-A | DIURETICS | MERCK & CO., INC. (US) | 1979-03-20 | — | — | US | disclosed |
| US-4145551-A | DIURETICS | MERCK & CO., INC. (US) | 1979-03-20 | — | — | US | disclosed |
| US-4145551-A | DIURETICS | MERCK & CO., INC. (US) | 1979-03-20 | — | — | US | disclosed |