Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4A11 | Q02928 | 4/20 | 0.46 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.46 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 6/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 5/20 | 0.37 |
| ▸ | NOS3 | P29474 | 3/20 | 0.37 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.35 |
| ▸ | HTR3B | O95264 | 1/20 | 0.35 |
| ▸ | HTR3A | P46098 | 1/20 | 0.35 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.35 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12094155 | 0.89 | TDP1 (0.46) | CYP4A11CYP4F2NOS1NOS2NOS3 | |
| SCHEMBL28201598 | 0.81 | SMN1; SMN2 (0.59) | CYP4A11CYP4F2 | |
| SCHEMBL1157243 | 0.80 | NOS1 (0.53) | NOS1NOS2NOS3 | |
| SCHEMBL241880 | 0.80 | CYP4F2 (0.53) | CYP4A11CYP4F2TBXA2RNOS1LTA4H | |
| SCHEMBL18403136 | 0.77 | TDP1 (0.46) | NOS1NOS2NOS3 | |
| SCHEMBL11973935 | 0.77 | GRIN2D (0.50) | NOS1NOS2 | |
| SCHEMBL12641204 | 0.77 | NOS1 (0.61) | NOS1NOS2NOS3 | |
| SCHEMBL82224 | 0.75 | HTR3E (0.59) | TBXA2RHTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL1244841 | 0.74 | CYP4F2 (0.49) | CYP4A11CYP4F2TBXA2RNOS1LTA4H | |
| SCHEMBL238401 | 0.73 | CYP4F2 (0.58) | CYP4A11CYP4F2TBXA2RNOS1CA2 |
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-2010085597-A1 | MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS | INCYTE CORPORATION (US) | 2010-07-29 | — | — | WO | disclosed |