Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | AR | P10275 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.38 |
| ▸ | AADAC | P22760 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 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 | |
|---|---|---|---|---|
| SCHEMBL13088890 | 0.83 | HTT (0.37) | ALDH1A1SMN1; SMN2HTTLMNACYP3A4 | |
| SCHEMBL13088959 | 0.76 | PDGFRB (0.46) | ALDH1A1HTTLMNAMEN1KMT2A | |
| SCHEMBL13088964 | 0.74 | TRPA1 (0.47) | ALDH1A1SMN1; SMN2HTTLMNACYP3A4 | |
| SCHEMBL13089070 | 0.68 | AKR1C3 (0.44) | ALDH1A1SMN1; SMN2HTTLMNACYP3A4 | |
| SCHEMBL12154447 | 0.65 | AR (0.57) | ALDH1A1SMN1; SMN2HTTLMNACYP3A4 | |
| SCHEMBL21250383 | 0.63 | HPGD (0.39) | ALDH1A1SMN1; SMN2HTTLMNACYP3A4 | |
| SCHEMBL12353836 | 0.63 | ALDH1A1 (0.37) | ALDH1A1SMN1; SMN2HTTLMNACYP3A4 | |
| SCHEMBL2239932 | 0.61 | PDGFRB (0.45) | ALDH1A1SMN1; SMN2HTTLMNACYP3A4 | |
| SCHEMBL18641484 | 0.61 | MAPT (0.49) | ALDH1A1HTTLMNACYP3A4CYP1A2 | |
| SCHEMBL13089072 | 0.60 | ALOX5 (0.50) | ALDH1A1SMN1; SMN2CYP1A2MAPK1CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2243779-A1 | BICYCLIC HETEROCYCLIC DERIVATIVE | Dainippon Sumitomo Pharma Co., Ltd. (JP) | 2010-10-27 | — | — | EP | disclosed |