Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27665850 | 0.85 | PPARG (0.41) | PPARGPPARALMNAALDH1A1CYP1A2 | |
| SCHEMBL27665344 | 0.84 | ALDH1A1 (0.43) | PPARGPPARACNR1SLC6A2SLC6A4 | |
| SCHEMBL27644419 | 0.84 | AKR1B1 (0.42) | SLC6A2SLC6A4SLC6A3SMN1; SMN2ALDH1A1 | |
| SCHEMBL27665530 | 0.84 | SLC6A2 (0.46) | SLC6A2SLC6A4SLC6A3NPC1SMN1; SMN2 | |
| SCHEMBL27644085 | 0.83 | CTSS (0.43) | PPARGPPARAALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL9696386 | 0.82 | BLM (0.49) | PPARGPPARANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL27665452 | 0.81 | PPARG (0.43) | PPARGPPARASLC6A2SLC6A4ALDH1A1 | |
| SCHEMBL27786243 | 0.79 | PPARG (0.43) | PPARGPPARACNR1SLC6A2SLC6A4 | |
| SCHEMBL27644388 | 0.79 | ESR1 (0.38) | PPARGPPARAALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL27644153 | 0.79 | CYP1A2 (0.33) | ALDH1A1CYP1A2POLB |
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-1886363-A | Amino acids with affinity for the alpha2delta-protein | WARNER LAMBERT CO (US) | 2006-12-27 | — | — | CN | claimed |
| CN-1886363-A | Amino acids with affinity for the alpha2delta-protein | WARNER LAMBERT CO (US) | 2006-12-27 | — | — | CN | disclosed |