Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 13/20 | 0.40 |
| ▸ | PDE2A | O00408 | 1/20 | 0.37 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20138813 | 0.81 | PDE4A (0.40) | CYP19A1PDE3BPDE3AKDM4EMEN1 | |
| SCHEMBL20142927 | 0.81 | PDE4A (0.40) | CYP19A1PDE3BPDE3AKDM4EMEN1 | |
| SCHEMBL20159190 | 0.81 | PDE4A (0.40) | CYP19A1PDE3BPDE3AKDM4EMEN1 | |
| SCHEMBL20159106 | 0.77 | HRH3 (0.38) | CYP19A1CES2KDM4EMEN1ALDH1A1 | |
| SCHEMBL20159497 | 0.75 | CYP19A1 (0.48) | CYP19A1CES2KDM4EMEN1ALDH1A1 | |
| SCHEMBL6655180 | 0.75 | PDE4B (0.44) | — | |
| SCHEMBL6842079 | 0.72 | PDE4B (0.52) | CYP19A1 | |
| SCHEMBL20142921 | 0.71 | PDE4B (0.40) | CYP19A1PDE3BPDE3ACES2KDM4E | |
| SCHEMBL6654160 | 0.71 | PDE4D (0.52) | PDE3BPDE3A | |
| SCHEMBL6684566 | 0.69 | PDE4D (0.48) | PDE3BPDE3A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018086703-A1 | DIHYDROPYRIDAZINONES SUBSTITUTED WITH PHENYLUREAS | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2018-05-17 | — | — | WO | disclosed |