Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.46 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.44 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.44 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.44 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.44 |
| ▸ | NOS3 | P29474 | 1/20 | 0.44 |
| ▸ | NOS1 | P29475 | 1/20 | 0.44 |
| ▸ | NOS2 | P35228 | 1/20 | 0.44 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.43 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.40 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.40 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.40 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.40 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.40 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.38 |
| ▸ | FGFR2 | P21802 | 2/20 | 0.38 |
| ▸ | FGFR3 | P22607 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PIP5K1C | O60331 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 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 | |
|---|---|---|---|---|
| SCHEMBL20912065 | 0.83 | KMT2A (0.40) | KEAP1KMT2ACCR1CCR5CCR8 | |
| SCHEMBL19480880 | 0.82 | ATR (0.42) | LRRK2PIK3CDPIK3CBPIK3CGKEAP1 | |
| SCHEMBL26916829 | 0.82 | KMT2A (0.43) | LRRK2PIK3CDPIK3CBPIK3CGKEAP1 | |
| SCHEMBL29857640 | 0.82 | KMT2A (0.43) | LRRK2PIK3CDPIK3CBPIK3CGKEAP1 | |
| SCHEMBL26917043 | 0.81 | PIK3CD (0.41) | LRRK2PIK3CDPIK3CBPIK3CGKEAP1 | |
| SCHEMBL19480879 | 0.77 | KEAP1 (0.43) | PIK3CDPIK3CBPIK3CGNOS3NOS1 | |
| SCHEMBL28983677 | 0.76 | PIK3CD (0.42) | PIK3CDPIK3CBPIK3CGKEAP1BMPR1A | |
| SCHEMBL30177024 | 0.76 | PIK3CD (0.42) | PIK3CDPIK3CBPIK3CGKEAP1BMPR1A | |
| SCHEMBL31512002 | 0.73 | NOS3 (0.46) | LRRK2PIK3CDPIK3CBPIK3CGNOS3 | |
| SCHEMBL19480883 | 0.72 | KEAP1 (0.46) | LRRK2NOS3NOS1NOS2KEAP1 |
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-2017178344-A1 | NOVEL N-[(HETEROARYLOXY)PROPANYL]HETEROARYL CARBOXAMIDES | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2017-10-19 | — | — | WO | disclosed |