Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 7/20 | 0.42 |
| ▸ | DRD3 | P35462 | 7/20 | 0.42 |
| ▸ | HTR2A | P28223 | 6/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | CACNB4 | O00305 | 1/20 | 0.38 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.38 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.38 |
| ▸ | CACNG3 | O60359 | 1/20 | 0.38 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.38 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.38 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.38 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.38 |
| ▸ | CACNG7 | P62955 | 1/20 | 0.38 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.38 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.38 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.38 |
| ▸ | CACNG1 | Q06432 | 1/20 | 0.38 |
| ▸ | CACNB2 | Q08289 | 1/20 | 0.38 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.38 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14852949 | 1.00 | DRD2 (0.42) | DRD2DRD3HTR2AHTR1ACACNB4 | |
| SCHEMBL16503556 | 0.89 | DRD2 (0.43) | DRD2DRD3HTR2AHTR1ACACNB4 | |
| SCHEMBL14852900 | 0.89 | DRD2 (0.43) | DRD2DRD3HTR2AHTR1ACACNB4 | |
| SCHEMBL13631305 | 0.78 | DGAT1 (0.36) | CHRM2 | |
| SCHEMBL14840918 | 0.77 | DRD2 (0.41) | DRD2DRD3HTR2AHTR1ACACNB4 | |
| SCHEMBL14840917 | 0.77 | DRD2 (0.41) | DRD2DRD3HTR2AHTR1ACACNB4 | |
| SCHEMBL17086457 | 0.77 | ALDH1A1 (0.41) | — | |
| SCHEMBL14948679 | 0.76 | AXL (0.33) | CHRM2CHRM1CHRM3 | |
| SCHEMBL17086375 | 0.76 | ESR1 (0.33) | CHRM2CHRM1CHRM3 | |
| SCHEMBL13631329 | 0.76 | ESR1 (0.33) | CHRM2CHRM1CHRM3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2397482-A1 | Heteroaryl imidazolone derivatives as jak inhibitors | Almirall, S.A. (ES) | 2011-12-21 | — | — | EP | disclosed |