Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 5/20 | 0.39 |
| ▸ | IRS1 | P35568 | 3/20 | 0.39 |
| ▸ | GAB1 | Q13480 | 3/20 | 0.39 |
| ▸ | DRD2 | P14416 | 3/20 | 0.32 |
| ▸ | DRD3 | P35462 | 3/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.31 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 2/20 | 0.31 |
| ▸ | HTR2C | P28335 | 2/20 | 0.31 |
| ▸ | HTR6 | P50406 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | MLNR | O43193 | 1/20 | 0.31 |
| ▸ | MMP1 | P03956 | 1/20 | 0.31 |
| ▸ | MMP3 | P08254 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL978076 | 0.82 | AKT1 (0.49) | AKT1IRS1GAB1DRD2DRD3 | |
| SCHEMBL13943189 | 0.80 | AKT1 (0.46) | AKT1IRS1GAB1DRD2DRD3 | |
| SCHEMBL3941641 | 0.78 | AKT1 (0.42) | AKT1IRS1GAB1DRD2DRD3 | |
| Trifluoroacetic Acid SCHEMBL981068 | 0.77 | S1PR4 (0.43) | AKT1IRS1GAB1DRD2DRD3 | |
| SCHEMBL979271 | 0.76 | AKT1 (0.47) | AKT1IRS1GAB1MCL1LMNA | |
| SCHEMBL980126 | 0.75 | AKT1 (0.46) | AKT1IRS1GAB1DRD2DRD3 | |
| SCHEMBL978720 | 0.74 | AKT1 (0.48) | AKT1IRS1GAB1DRD2DRD3 | |
| SCHEMBL15623169 | 0.72 | AKT1 (0.45) | AKT1IRS1GAB1DRD2DRD3 | |
| SCHEMBL981069 | 0.71 | FAAH (0.39) | AKT1IRS1GAB1DRD2DRD3 | |
| SCHEMBL979272 | 0.71 | AKT1 (0.46) | AKT1IRS1GAB1DRD2DRD3 |
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-2009015485-A1 | CYCLIC INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER | UNIVERSITY HEALTH NETWORK (CA) | 2009-02-05 | — | — | WO | disclosed |