Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 2/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 3/20 | 0.39 |
| ▸ | GPR3 | P46089 | 1/20 | 0.34 |
| ▸ | CETP | P11597 | 2/20 | 0.33 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.32 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15787208 | 0.84 | GRIN2B (0.40) | GRIN2BFFAR4GPR3EPHX1NOS2 | |
| SCHEMBL31462949 | 0.83 | FFAR4 (0.37) | FFAR4GPR3CETPACACBCHRM2 | |
| SCHEMBL24180116 | 0.83 | FFAR4 (0.37) | FFAR4GPR3CETPACACBCHRM2 | |
| SCHEMBL13185385 | 0.82 | GRIN2B (0.44) | GRIN2BFFAR4GPR3CETPBCHE | |
| SCHEMBL17365372 | 0.82 | GRIN2B (0.39) | GRIN2BFFAR4GPR3EPHX1NOS2 | |
| SCHEMBL16959251 | 0.81 | ACACB (0.32) | CETPACACBCHRM2CHRM1CHRM3 | |
| SCHEMBL10159776 | 0.81 | GRIN2B (0.40) | GRIN2BFFAR4CETPACACBPTGER4 | |
| SCHEMBL16961707 | 0.81 | FFAR4 (0.40) | GRIN2BFFAR4CETPACACBCHRM2 | |
| SCHEMBL15787461 | 0.80 | GRIN2B (0.42) | GRIN2BFFAR4CETPEPHX1PTGER4 | |
| SCHEMBL15787454 | 0.80 | GRIN2B (0.42) | GRIN2BFFAR4CETPEPHX1PTGER4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023154291-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2023-08-17 | — | — | WO | disclosed |
| EP-2900645-A1 | 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION | Bayer CropScience AG (DE) | 2015-08-05 | — | — | EP | disclosed |