Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.32 |
| ▸ | TAS1R1 | Q7RTX1 | 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 | |
|---|---|---|---|---|
| SCHEMBL12462086 | 0.86 | ALOX5 (0.36) | ALOX5DRD2DRD3ESR1ESR2 | |
| SCHEMBL20963155 | 0.86 | ALOX5 (0.36) | ALOX5DRD2DRD3ESR1ESR2 | |
| SCHEMBL13848615 | 0.80 | CHRNB2 (0.36) | ALOX5DRD2DRD3ESR1ESR2 | |
| SCHEMBL12193852 | 0.77 | CHRNB2 (0.34) | ALOX5DRD2DRD3ESR1ESR2 | |
| SCHEMBL11956268 | 0.75 | ALOX5 (0.41) | ALOX5DRD2DRD3CHRNB2CHRNB4 | |
| Bromide SCHEMBL27340514 | 0.75 | CCR1 (0.42) | ALOX5DRD2DRD3CHRNB2CHRNB4 | |
| Bromide SCHEMBL27543765 | 0.75 | CCR1 (0.42) | ALOX5DRD2DRD3CHRNB2CHRNB4 | |
| SCHEMBL20760340 | 0.75 | NR1I2 (0.39) | ALOX5CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL20987465 | 0.73 | ALOX5 (0.34) | ALOX5DRD2DRD3ESR1ESR2 | |
| SCHEMBL12303168 | 0.72 | ALOX5 (0.39) | ALOX5DRD2DRD3CHRNB2CHRNB4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1226886-A | Arylcycloalkane carboxylic acid esters, their use, pharmaceutical compositions and process for their preparation | PHARMACIA & UPJOHN AB (SE) | 1999-08-25 | — | — | CN | disclosed |