Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19118465 | 0.82 | PDE4B (0.66) | PDE4BSMN1; SMN2GAAKDM4EALDH1A1 | |
| SCHEMBL19118469 | 0.82 | PDE4B (0.54) | PDE4BNPC1MEN1KMT2AKDM4E | |
| SCHEMBL19119079 | 0.78 | PDE4B (0.71) | PDE4B | |
| SCHEMBL16446595 | 0.78 | PDE4B (0.66) | PDE4B | |
| SCHEMBL16447019 | 0.78 | PDE4B (0.82) | PDE4BLMNATSHRHPGD | |
| SCHEMBL19118473 | 0.76 | PDE4B (0.54) | PDE4BNPC1FFAR1LMNAGAA | |
| SCHEMBL16446717 | 0.69 | PDE4B (0.75) | PDE4BLMNAKDM4EMAPTTSHR | |
| SCHEMBL19119080 | 0.69 | PDE4B (0.65) | PDE4BFFAR1GAAKDM4EALDH1A1 | |
| SCHEMBL16446304 | 0.68 | PDE4B (0.67) | PDE4BSMN1; SMN2LMNAKDM4EALDH1A1 | |
| SCHEMBL16446831 | 0.68 | PDE4B (0.53) | PDE4BMEN1KMT2ASMN1; SMN2LMNA |
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-3030565-B1 | NOVEL SUBSTITUTED CONDENSED PYRIMIDINE COMPOUNDS | GRUENENTHAL GMBH (DE) | 2017-07-19 | — | — | EP | disclosed |