Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 7/20 | 0.38 |
| ▸ | HTR3A | P46098 | 3/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | PHGDH | O43175 | 3/20 | 0.33 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | DRD4 | P21917 | 1/20 | 0.31 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.31 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.31 |
| ▸ | CDK1 | P06493 | 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 | |
|---|---|---|---|---|
| SCHEMBL12872284 | 1.00 | HRH4 (0.38) | HRH4HTR3AGRM5AKR1C3TRPV3 | |
| SCHEMBL12872295 | 0.91 | TRPV3 (0.39) | HRH4HTR3AGRM5TRPV3LMNA | |
| SCHEMBL3046733 | 0.88 | HTR3A (0.36) | HRH4HTR3ATRPV3KDM4EGAA | |
| SCHEMBL3046737 | 0.88 | HTR3A (0.36) | HRH4HTR3ATRPV3KDM4EGAA | |
| SCHEMBL12872225 | 0.87 | MAT2A (0.35) | HRH4HTR3AGRM5TRPV3LMNA | |
| SCHEMBL8033487 | 0.87 | MAT2A (0.35) | HRH4HTR3AGRM5TRPV3LMNA | |
| SCHEMBL9275439 | 0.86 | HTR3A (0.34) | HRH4HTR3ATRPV3KDM4EMAPT | |
| SCHEMBL12872285 | 0.86 | HTR3A (0.34) | HRH4HTR3ATRPV3KDM4EMAPT | |
| SCHEMBL1188334 | 0.85 | HTR3A (0.32) | HRH4HTR3AC5AR1DRD2DRD4 | |
| SCHEMBL8032394 | 0.85 | HTR3A (0.32) | HRH4HTR3AC5AR1DRD2DRD4 |
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-2214673-B1 | PHENYL-SUBSTITUTED PIPERAZINO-DIHYDROTHIENOPYRIMIDINES | BOEHRINGER INGELHEIM INT (DE) | 2012-05-30 | — | — | EP | disclosed |
| WO-2009053268-A1 | NOVEL PHENYL-SUBSTITUTED PIPERAZINO-DIHYDROTHIENOPYRIMIDINES | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-04-30 | — | — | WO | disclosed |