Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 7/20 | 0.35 |
| ▸ | DRD2 | P14416 | 5/20 | 0.35 |
| ▸ | DRD3 | P35462 | 4/20 | 0.35 |
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 2/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.33 |
| ▸ | BPTF | Q12830 | 1/20 | 0.33 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14706818 | 0.84 | ERCC5 (0.41) | DRD4DRD2DRD3HTR2C | |
| SCHEMBL19368160 | 0.83 | DRD2 (0.49) | DRD4DRD2DRD3 | |
| SCHEMBL14706776 | 0.82 | DRD4 (0.51) | DRD4DRD2DRD3ACACBHTR2C | |
| SCHEMBL12194623 | 0.81 | ACACB (0.39) | DRD4DRD2DRD3ACACBHTR2C | |
| SCHEMBL12853640 | 0.81 | FEN1 (0.40) | DRD4DRD2DRD3 | |
| SCHEMBL27706821 | 0.79 | GABRA1 (0.39) | GABRA1GABRR1GABRA3GABRA2GABRB2 | |
| SCHEMBL1930732 | 0.79 | GABRA1 (0.43) | GABRA1GABRR1GABRA3GABRA2GABRB2 | |
| SCHEMBL28806356 | 0.79 | PARP1 (0.39) | GABRA1GABRR1GABRA3GABRA2GABRB2 | |
| SCHEMBL14478219 | 0.76 | SLC6A2 (0.52) | DRD4DRD2DRD3ACACBHTR2C | |
| SCHEMBL1312810 | 0.75 | DRD4 (0.44) | DRD4DRD2DRD3HTR2C |
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 |
|---|---|---|---|---|---|---|---|
| US-8278337-B2 | Substituted pyridines that are JNK inhibitors | MERCK SHARP & DOHME (US) | 2012-10-02 | — | — | US | disclosed |
| US-8278337-B2 | Substituted pyridines that are JNK inhibitors | MERCK SHARP & DOHME (US) | 2012-10-02 | — | — | US | disclosed |