Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE1B | Q01064 | 2/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PDE1A | P54750 | 1/20 | 0.32 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 12/20 | 0.32 |
| ▸ | DRD2 | P14416 | 9/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | TDP2 | O95551 | 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 | |
|---|---|---|---|---|
| SCHEMBL4872348 | 0.73 | PDE1B (0.38) | PDE1BHSD11B1MEN1KMT2APDE1A | |
| SCHEMBL17712727 | 0.70 | MEN1 (0.64) | MEN1KMT2ADRD3DRD2KCNH2 | |
| SCHEMBL17712756 | 0.68 | PRKDC (0.39) | PDE1BHSD11B1MEN1KMT2APDE1A | |
| SCHEMBL18488318 | 0.66 | DRD2 (0.53) | DRD3DRD2KCNH2CHRM1CHRM3 | |
| SCHEMBL3554142 | 0.65 | HSD11B1 (0.46) | PDE1BHSD11B1MEN1KMT2ADRD3 | |
| SCHEMBL1881004 | 0.62 | DRD3 (0.44) | PDE1BDRD3DRD2KCNH2CHRM1 | |
| SCHEMBL378959 | 0.62 | DRD3 (0.53) | DRD3DRD2KCNH2CHRM1CHRM3 | |
| SCHEMBL1877389 | 0.62 | DRD3 (0.46) | PDE1BPDE1APDE1CDRD3DRD2 | |
| SCHEMBL27217103 | 0.61 | PDE1B (0.38) | PDE1BPDE1APDE1CTDP2 | |
| SCHEMBL27217041 | 0.61 | PDE1B (0.57) | PDE1BPDE1APDE1C |
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 |
|---|---|---|---|---|---|---|---|
| EP-3212637-B1 | DOPAMINE D3 RECEPTOR ANTAGONISTS COMPOUNDS | INDIVIOR UK LTD (GB) | 2021-06-02 | — | — | EP | disclosed |
| EP-3331886-B1 | DOPAMINE D3 RECEPTOR ANTAGONISTS HAVING A BICYCLO MOIETY | INDIVIOR UK LTD (GB) | 2020-07-15 | — | — | EP | disclosed |