Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 10/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 9/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.36 |
| ▸ | WNT1 | P04628 | 2/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | GPER1 | Q99527 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | TDO2 | P48775 | 1/20 | 0.34 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27706479 | 0.90 | ROCK2 (0.35) | IDO1TDO2 | |
| SCHEMBL5096924 | 0.81 | PIK3CA (0.43) | CYP11B1CYP11B2DYRK1AWNT1PIK3CA | |
| SCHEMBL27706482 | 0.80 | — | — | |
| SCHEMBL27706460 | 0.79 | CYP11B1 (0.38) | CYP11B1CYP11B2TNIKCYP17A1CYP19A1 | |
| SCHEMBL5091881 | 0.77 | ACHE (0.46) | DYRK1AWNT1PIK3CADRD2DRD3 | |
| SCHEMBL5094873 | 0.77 | CYP1A2 (0.43) | CYP11B1CYP11B2DYRK1AWNT1CYP17A1 | |
| SCHEMBL27706490 | 0.77 | CYP11B1 (0.36) | CYP11B1CYP11B2DYRK1AWNT1PIK3CA | |
| SCHEMBL5091955 | 0.76 | DRD2 (0.49) | CYP11B1CYP11B2DRD2HTR2ADRD3 | |
| SCHEMBL5091017 | 0.74 | ABCB1 (0.43) | CYP11B1CYP11B2DYRK1AWNT1DRD2 | |
| SCHEMBL5103707 | 0.74 | ACHE (0.38) | CYP11B1CYP11B2DYRK1AWNT1HTR2A |
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-101128458-A | Tricyclic delta opioid modulators | JANSSEN PHARMACEUTICA NV (BE) | 2008-02-20 | — | — | CN | disclosed |