Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE7A | Q13946 | 2/20 | 0.48 |
| ▸ | PPARG | P37231 | 5/20 | 0.43 |
| ▸ | PPARA | Q07869 | 4/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.37 |
| ▸ | PPARD | Q03181 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2940891 | 0.82 | NFE2L2 (0.42) | PPARGPPARASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL26154107 | 0.81 | TNK2 (0.46) | PPARGPPARASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL554256 | 0.80 | ALDH1A1 (0.54) | KCNH2HAO1MAOAMAOBBACE1 | |
| SCHEMBL5682640 | 0.79 | HAO1 (0.43) | SLC6A2SLC6A4SLC6A3KCNH2CYP2D6 | |
| SCHEMBL8578089 | 0.78 | ALDH1A1 (0.56) | KCNH2HAO1MAOAMAOBNFE2L2 | |
| SCHEMBL21765332 | 0.77 | MAPT (0.45) | PDE7ASLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL15055573 | 0.77 | HAO1 (0.42) | SLC6A2SLC6A4SLC6A3KCNH2HAO1 | |
| SCHEMBL3545617 | 0.77 | PTGDR2 (0.51) | PDE7ASLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL4318630 | 0.76 | PDE7A (0.63) | PDE7ASLC6A4CYP2D6MAOAMAOB | |
| SCHEMBL554841 | 0.75 | ALDH1A1 (0.58) | KCNH2MAOAMAOBSMN1; SMN2MEN1 |
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-2020190774-A1 | NOVEL SMALL MOLECULE INHIBITORS OF TEAD TRANSCRIPTION FACTORS | THE GENERAL HOSPITAL CORPORATION (US) | 2020-09-24 | — | — | WO | disclosed |