Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.40 |
| ▸ | ABHD6 | Q9BV23 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.39 |
| ▸ | F10 | P00742 | 7/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 7/20 | 0.38 |
| ▸ | PRSS2 | P07478 | 7/20 | 0.38 |
| ▸ | PRSS3 | P35030 | 7/20 | 0.38 |
| ▸ | PLG | P00747 | 5/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL373982 | 0.80 | HRH3 (0.59) | ESR1ESR2HRH3ABHD6CYP2D6 | |
| SCHEMBL974823 | 0.76 | GPR119 (0.56) | ESR1ESR2HRH3CYP2D6ALK | |
| SCHEMBL2309023 | 0.74 | ESR1 (0.85) | ESR1ESR2ABHD6 | |
| SCHEMBL373986 | 0.73 | ESR2 (0.49) | ESR1ESR2HRH3ABHD6CYP2D6 | |
| SCHEMBL7854911 | 0.70 | ESR1 (0.70) | ESR1ESR2HRH3ABHD6PDE4B | |
| SCHEMBL373718 | 0.70 | ESR1 (0.58) | ESR1ESR2ABHD6PKM | |
| SCHEMBL31164691 | 0.69 | ESR1 (0.90) | ESR1ESR2ABHD6PKM | |
| SCHEMBL2364767 | 0.69 | ESR1 (0.60) | ESR1ESR2HRH3ABHD6CYP2D6 | |
| SCHEMBL373697 | 0.68 | ESR2 (0.83) | ESR1ESR2ABHD6 | |
| SCHEMBL8176141 | 0.68 | ESR1 (0.61) | ESR1ESR2HRH3ABHD6PDE4B |
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-2380891-A1 | Substituted piperidino-dihydrothienopyrimidines | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2011-10-26 | — | — | EP | disclosed |