Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 4/20 | 0.37 |
| ▸ | PPARA | Q07869 | 4/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL381892 | 0.81 | AAK1 (0.48) | AAK1PPARGPPARAPGRADRA2A | |
| SCHEMBL1068928 | 0.81 | AAK1 (0.43) | AAK1PPARGPPARAPGRADRA2A | |
| SCHEMBL1068927 | 0.81 | AAK1 (0.43) | AAK1PPARGPPARAPGRADRA2A | |
| SCHEMBL7711956 | 0.79 | AAK1 (0.47) | AAK1PPARGPPARAPGRADRA2A | |
| SCHEMBL18762539 | 0.79 | AAK1 (0.44) | AAK1PPARGPPARAPGRADRA2A | |
| SCHEMBL1741951 | 0.79 | AAK1 (0.46) | AAK1PGRADRA2AADRA2BHTR2A | |
| SCHEMBL20786122 | 0.76 | AAK1 (0.47) | AAK1SLC6A2SLC6A3PPARGPPARA | |
| SCHEMBL14493754 | 0.74 | AAK1 (0.54) | AAK1SLC6A2SLC6A3PPARGPPARA | |
| SCHEMBL14879812 | 0.73 | AAK1 (0.47) | AAK1PPARGPPARAPGRADRA2A | |
| SCHEMBL16119517 | 0.73 | AAK1 (0.47) | AAK1PPARGPPARAPGRADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-102007118-A | Pyrrolidinone glucokinase activators | HOFFMANN LA ROCHE | 2011-04-06 | — | — | CN | disclosed |