Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 3/20 | 0.35 |
| ▸ | CA9 | Q16790 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.35 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1448079 | 0.86 | CYP11B1 (0.39) | HTR2CCA12CA9CA1CA2 | |
| SCHEMBL1091043 | 0.72 | CA12 (0.39) | EHMT2PDE3BPDE3ACA12CA9 | |
| SCHEMBL326339 | 0.68 | DRD2 (0.41) | CA12CA9CA1CA2CA7 | |
| SCHEMBL1478437 | 0.66 | MPO (0.42) | HTR2CCA2CYP11B2 | |
| SCHEMBL30134456 | 0.66 | MPO (0.42) | HTR2CCA2CYP11B2 | |
| SCHEMBL8884488 | 0.65 | CA2 (0.50) | CA12CA9CA1CA2CA7 | |
| SCHEMBL9549912 | 0.65 | TRPA1 (0.34) | EHMT2PDE3BPDE3ACA12CA9 | |
| SCHEMBL4366398 | 0.64 | PDE3B (0.41) | PDE3BPDE3ACA12CA9CA1 | |
| SCHEMBL5229806 | 0.64 | CA12 (0.49) | CA12CA9CA2MEN1KMT2A | |
| SCHEMBL30545230 | 0.64 | CA12 (0.49) | CA12CA9CA2MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4201923-A1 | 5-SUBSTITUTED 2,3-DIHYDROPYRIDIN-4-ONES AND PROCESS FOR PREPARING THE SAME | Karl-Franzens-Universität Graz (AT) | 2023-06-28 | — | — | EP | disclosed |
| EP-3666757-A1 | PROCESS FOR PREPARING A PIPERIDIN-4-ONE | Karl-Franzens-Universität Graz (AT) | 2020-06-17 | — | — | EP | disclosed |
| EP-2301627-A1 | Novel antimalarial 3-azabicyclo[3.2.2]nonane derivatives | University of Graz (AT) | 2011-03-30 | — | — | EP | disclosed |