Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1B | P28222 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CHAT | P28329 | 2/20 | 0.36 |
| ▸ | CNR1 | P21554 | 2/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1609445 | 1.00 | HTR1B (0.37) | HTR1BGAATDP1L3MBTL1CHAT | |
| SCHEMBL1610676 | 0.95 | CNR1 (0.38) | HTR1BGAATDP1L3MBTL1CHAT | |
| SCHEMBL1612559 | 0.94 | CHAT (0.40) | HTR1BGAATDP1L3MBTL1CHAT | |
| SCHEMBL1610598 | 0.90 | CHAT (0.38) | HTR1BTDP1CHATHTR1DCA1 | |
| SCHEMBL1611797 | 0.87 | MEN1 (0.35) | GAATDP1ALDH1A1MAPTKDM4E | |
| SCHEMBL1610267 | 0.83 | MAPT (0.35) | GAACHATCNR1ALDH1A1MAPT | |
| SCHEMBL1611479 | 0.82 | CHAT (0.40) | TDP1CHATCA1CA2ALDH1A1 | |
| SCHEMBL1611237 | 0.81 | MAPT (0.37) | CHATCNR1MAPTMEN1NPC1 | |
| SCHEMBL1610913 | 0.78 | MAPT (0.38) | GAATDP1L3MBTL1ALDH1A1MAPT | |
| SCHEMBL1609667 | 0.77 | TSHR (0.41) | GRM5 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1039321-C | New beta-amino-alpha-hydroxycarboxylic acids and their use | SANKYO CO (JP) | 1998-07-29 | — | — | CN | disclosed |
| CN-1064683-A | New beta-amino-alpha-hydroxycarboxylic acids and uses thereof | SANKYO CO (JP) | 1992-09-23 | — | — | CN | disclosed |