Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | MTOR | P42345 | 1/20 | 0.52 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.52 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
| ▸ | CASP7 | P55210 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 6/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.46 |
| ▸ | RPS6KA2 | Q15349 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6505339 | 0.72 | KDM4E (0.69) | SMN1; SMN2KDM4ENPSR1MTORIRAK1 | |
| SCHEMBL16261073 | 0.71 | MTOR (0.74) | SMN1; SMN2KDM4ENPSR1MTORIRAK1 | |
| SCHEMBL5813832 | 0.71 | SMN1; SMN2 (0.98) | SMN1; SMN2KDM4EALDH1A1GAA | |
| SCHEMBL2772319 | 0.70 | SMN1; SMN2 (0.72) | SMN1; SMN2TP53HSD17B10ALDH1A1GAA | |
| SCHEMBL13500540 | 0.70 | OPRK1 (0.86) | SMN1; SMN2KDM4ENPSR1MTORIRAK1 | |
| SCHEMBL6530642 | 0.69 | KDM4E (1.00) | SMN1; SMN2KDM4ENPSR1MTORIRAK1 | |
| SCHEMBL3600001 | 0.69 | MTOR (0.70) | SMN1; SMN2KDM4ENPSR1MTORIRAK1 | |
| SCHEMBL28694253 | 0.69 | SMN1; SMN2 (0.71) | SMN1; SMN2TP53NPC1ALDH1A1RAB9A | |
| SCHEMBL17554115 | 0.69 | POLB (0.69) | SMN1; SMN2ALDH1A1GAA | |
| SCHEMBL3606266 | 0.69 | CLK2 (0.72) | KDM4ENPSR1MTORIRAK1IRAK4 |
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-2005021547-A2 | HETEROCYCLIC CANNABINOID CB2 RECEPTOR ANTAGONISTS | PHARMAXIS PTY LTD. (AU) | 2005-03-10 | — | — | WO | disclosed |