Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | XBP1 | P17861 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 4/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.32 |
| ▸ | MME | P08473 | 1/20 | 0.32 |
| ▸ | ACE | P12821 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | HHAT | Q5VTY9 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4423580 | 0.89 | ALDH1A1 (0.41) | ALDH1A1XBP1HTTMTNR1AMTNR1B | |
| SCHEMBL4410486 | 0.82 | HTR2C (0.44) | ALDH1A1MTNR1AMTNR1BHTR2CSLC6A3 | |
| SCHEMBL4551783 | 0.73 | MTNR1B (0.40) | ALDH1A1XBP1HTTMTNR1AMTNR1B | |
| SCHEMBL4411576 | 0.71 | MTNR1A (0.43) | ALDH1A1MTNR1AMTNR1BGAAL3MBTL1 | |
| SCHEMBL4412361 | 0.67 | CHRM2 (0.44) | ALDH1A1RAB9AGAA | |
| SCHEMBL4565179 | 0.65 | MTNR1A (0.36) | ALDH1A1MTNR1AMTNR1BHTR2CSLC6A3 | |
| SCHEMBL4565178 | 0.65 | MTNR1A (0.36) | ALDH1A1MTNR1AMTNR1BHTR2CSLC6A3 | |
| SCHEMBL1567103 | 0.65 | MTNR1A (0.56) | MTNR1AMTNR1BFFAR1HTR2CSLC6A3 | |
| SCHEMBL9348177 | 0.62 | SLC6A9 (0.41) | MTNR1AMTNR1BFFAR1HTR2CSLC6A3 | |
| SCHEMBL9633773 | 0.60 | ALDH1A1 (0.46) | ALDH1A1XBP1HTTFFAR1HTR2C |
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-2009110002-A1 | NOVEL EFFLUX PUMP INHIBITORS | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2009-09-11 | — | — | WO | disclosed |