Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 7/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 7/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 7/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12188705 | 0.78 | RXRA (0.33) | RXRAGRIN1GRIN2BPARP1NOS3 | |
| SCHEMBL17778484 | 0.77 | NOS3 (0.35) | PARP1NOS3NOS1NOS2KDM4E | |
| SCHEMBL17553917 | 0.77 | VRK1 (0.35) | RXRAGRIN1GRIN2BPARP1NOS3 | |
| SCHEMBL12090962 | 0.77 | RXRA (0.33) | RXRAGRIN1GRIN2BPARP1NOS3 | |
| SCHEMBL12020099 | 0.75 | CPB2 (0.41) | PARP1NOS3NOS1NOS2NPC1 | |
| SCHEMBL19831178 | 0.75 | RXRA (0.35) | RXRAGRIN1GRIN2BPARP1NOS3 | |
| SCHEMBL22748099 | 0.75 | PARP1 (0.32) | PARP1NOS3NOS1NOS2KDM4E | |
| SCHEMBL6468592 | 0.75 | TLR7 (0.38) | RXRAGRIN1GRIN2BPARP1NOS3 | |
| SCHEMBL25086289 | 0.72 | PTGS2 (0.33) | RXRAGRIN1GRIN2BPARP1 | |
| SCHEMBL16647838 | 0.72 | RXRA (0.35) | RXRAGRIN1GRIN2BPARP1KDM4E |
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-2018019711-A1 | SUBSTITUTED HALOGEN(THIO)ACYL COMPOUNDS | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2018-02-01 | — | — | WO | disclosed |