Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1B | P49286 | 3/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 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 | |
|---|---|---|---|---|
| SCHEMBL4565179 | 0.90 | MTNR1A (0.36) | MTNR1BMTNR1AHTR2CSLC6A3CHRM1 | |
| SCHEMBL4565178 | 0.90 | MTNR1A (0.36) | MTNR1BMTNR1AHTR2CSLC6A3CHRM1 | |
| SCHEMBL4410486 | 0.80 | HTR2C (0.44) | MTNR1BMTNR1AHTR2CSLC6A3GAA | |
| SCHEMBL4423580 | 0.74 | ALDH1A1 (0.41) | MTNR1BMTNR1AHTR2CFFAR1CHRM1 | |
| SCHEMBL4275385 | 0.73 | ALDH1A1 (0.34) | MTNR1BMTNR1AHTR2CSLC6A3FFAR1 | |
| SCHEMBL9633773 | 0.69 | ALDH1A1 (0.46) | HTR2CSLC6A3FFAR1L3MBTL1ALDH1A1 | |
| SCHEMBL29547070 | 0.67 | PIN1 (0.45) | HTR2CSLC6A3GAAL3MBTL1 | |
| SCHEMBL9266532 | 0.67 | CYP1A2 (0.46) | ALDH1A1HTTEPHX2 | |
| SCHEMBL4412361 | 0.67 | CHRM2 (0.44) | CHRM1CHRM3GAAALDH1A1 | |
| D-Glutamate SCHEMBL7943997 | 0.66 | GRM8 (0.47) | HTR2CSLC6A3 |
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 |