Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 4/20 | 0.50 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.50 |
| ▸ | TLR4 | O00206 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5949519 | 0.82 | MTNR1A (0.50) | MTNR1AMTNR1BTLR4ATMALDH1A1 | |
| SCHEMBL658632 | 0.82 | MTNR1A (0.50) | MTNR1AMTNR1BTLR4ATMALDH1A1 | |
| SCHEMBL14274551 | 0.80 | MTNR1A (0.49) | MTNR1AMTNR1BTLR4ATMALDH1A1 | |
| SCHEMBL284342 | 0.80 | ATM (0.56) | MTNR1AMTNR1BTLR4ATMALDH1A1 | |
| SCHEMBL284318 | 0.80 | ATM (0.56) | MTNR1AMTNR1BTLR4ATMALDH1A1 | |
| SCHEMBL50350 | 0.80 | — | — | |
| SCHEMBL284319 | 0.80 | ATM (0.56) | MTNR1AMTNR1BTLR4ATMALDH1A1 | |
| Water SCHEMBL27364290 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL27752288 | 0.78 | — | — | |
| Bicarbonate SCHEMBL11027352 | 0.75 | ATM (0.52) | MTNR1AMTNR1BTLR4ATMALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013027001-A1 | COMPOUNDS AND THEIR USE TO TREAT HISTAMINE H3 RELATED DISORDERS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2013-02-28 | — | — | WO | disclosed |