Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 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 | |
|---|---|---|---|---|
| SCHEMBL29017348 | 0.87 | DPP4 (0.46) | DPP4SLC6A4SLC6A2SLC6A3LMNA | |
| SCHEMBL29017424 | 0.87 | DPP4 (0.46) | DPP4SLC6A4SLC6A2SLC6A3LMNA | |
| SCHEMBL3380377 | 0.83 | ACSS2 (0.43) | DPP4CYP2D6EPHX2SLC6A4SLC6A2 | |
| SCHEMBL29017350 | 0.81 | ICMT (0.39) | DPP4CYP2D6EPHX2MAOAMAOB | |
| SCHEMBL18440465 | 0.81 | DPP4 (0.53) | DPP4CYP2D6EPHX2SLC6A4SLC6A2 | |
| SCHEMBL15577241 | 0.80 | ICMT (0.51) | DPP4LMNAMAOAMAOBTAAR1 | |
| SCHEMBL15577265 | 0.79 | TSHR (0.54) | DPP4EPHX2LMNAMEN1KMT2A | |
| SCHEMBL24641080 | 0.77 | MAOA (0.42) | DPP4SLC6A4SLC6A2SLC6A3LMNA | |
| SCHEMBL1124803 | 0.77 | MAOA (0.56) | DPP4CYP2D6EPHX2SLC6A4SLC6A2 | |
| SCHEMBL29017375 | 0.76 | MAOA (0.42) | DPP4MAOAMAOBTAAR1MAPK1 |
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-2014041349-A1 | TETRAHYDROPYRAN-4-YLETHYLAMINO- OR TETRAHYDROPYRANYL-4-ETHYLOXY-PYRIMIDINES OR -PYRIDAZINES AS ISOPRENYLCYSTEINCARBOXYMETHYL TRANSFERASE INHIBITORS | CANCER THERAPEUTICS CRC PTY LTD (AU) | 2014-03-20 | — | — | WO | disclosed |