Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 3/20 | 0.51 |
| ▸ | GPR119 | Q8TDV5 | 5/20 | 0.48 |
| ▸ | DPP9 | Q86TI2 | 3/20 | 0.41 |
| ▸ | DPP4 | P27487 | 2/20 | 0.41 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.41 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.41 |
| ▸ | ACACB | O00763 | 1/20 | 0.41 |
| ▸ | ACACA | Q13085 | 1/20 | 0.41 |
| ▸ | ABHD6 | Q9BV23 | 2/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20220626 | 0.86 | ABHD6 (0.54) | ADRA1AGPR119ABHD6CHRM2CHRM1 | |
| SCHEMBL20220386 | 0.85 | ADRA1A (0.48) | ADRA1AGPR119ACACBACACAABHD6 | |
| SCHEMBL3768604 | 0.84 | ESR2 (0.53) | ADRA1AGPR119HRH3NAMPT | |
| SCHEMBL2573737 | 0.82 | ADRA1A (0.52) | ADRA1ADPP9DPP4DPP8HRH3 | |
| SCHEMBL20220387 | 0.81 | CHRM2 (0.52) | ADRA1AGPR119ABHD6CHRM2CHRM1 | |
| SCHEMBL16824264 | 0.80 | NR1H2 (0.52) | ADRA1AGPR119HRH3 | |
| SCHEMBL18186148 | 0.77 | ADRA1A (0.52) | ADRA1ADPP9DPP4DPP8HRH3 | |
| SCHEMBL20312212 | 0.73 | ADRA1A (0.47) | ADRA1ADPP9DPP4DPP8DPP7 | |
| SCHEMBL16835561 | 0.73 | ADRA1A (0.68) | ADRA1AHRH3NAMPT | |
| SCHEMBL28099009 | 0.73 | CXCR3 (0.45) | ADRA1AHRH3 |
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-3083592-B1 | SUBSTITUTED PIPERIDINYL-TETRAHYDROQUINOLINES AND THEIR USE AS ALPHA-2C ADRENORECEPTOR ANTAGONISTS | Bayer Pharma AG (DE) | 2018-06-27 | — | — | EP | disclosed |
| EP-3329920-A2 | ADRENORECEPTOR ALPHA2C RECEPTOR ANTAGONISTS | Bayer Pharma Aktiengesellschaft (DE) | 2018-06-06 | — | — | EP | disclosed |