Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | RECQL | P46063 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.40 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12889090 | 0.86 | TSHR (0.49) | TSHRALDH1A1RECQLGAAKDM4E | |
| SCHEMBL8313639 | 0.84 | LTA4H (0.52) | TSHRALDH1A1RECQLGAAKDM4E | |
| SCHEMBL8610137 | 0.83 | MAOA (0.44) | TSHRALDH1A1RECQLGAAKDM4E | |
| SCHEMBL601344 | 0.83 | ALDH1A1 (0.54) | TSHRALDH1A1RECQLGAAKDM4E | |
| SCHEMBL15929955 | 0.83 | TSHR (0.48) | TSHRALDH1A1RECQLGAAKDM4E | |
| Hydrochloric Acid SCHEMBL9234601 | 0.81 | MAOA (0.43) | TSHRALDH1A1RECQLGAAKDM4E | |
| SCHEMBL2361759 | 0.81 | TSHR (0.50) | TSHRALDH1A1RECQLGAAKDM4E | |
| SCHEMBL11570420 | 0.81 | TSHR (0.52) | TSHRALDH1A1RECQLGAAKDM4E | |
| SCHEMBL2733181 | 0.81 | MAOA (0.53) | TSHRALDH1A1RECQLGAAKDM4E | |
| Ammonia Solution, Strong SCHEMBL27509242 | 0.81 | ALDH1A1 (0.52) | TSHRALDH1A1RECQLGAAKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010111634-A2 | RENIN INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-09-30 | — | — | WO | disclosed |
| CN-1033327-C | Process for preparing tricyclotriazolo derivatives and their use | TORAY INDUSTRIES (JP) | 1996-11-20 | — | — | CN | disclosed |
| CN-1066849-A | Three ring triazolo derivatives, its Manufacturing approach and use | TORAY INDUSTRIES (JP) | 1992-12-09 | — | — | CN | disclosed |