Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 10/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | CASR | P41180 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7468181 | 0.88 | CCR5 (0.50) | CCR5HTTADRA2AADRA2CDRD3 | |
| SCHEMBL7464238 | 0.87 | CCR5 (0.53) | CCR5SIGMAR1 | |
| Hydrochloric Acid SCHEMBL7470069 | 0.86 | CCR5 (0.52) | CCR5SIGMAR1 | |
| SCHEMBL7456202 | 0.85 | CCR5 (0.49) | CCR5SIGMAR1MEN1ALDH1A1KMT2A | |
| SCHEMBL7466072 | 0.84 | OPRD1 (0.48) | CCR5DRD3MEN1ALDH1A1KMT2A | |
| Fumaric Acid SCHEMBL7462667 | 0.84 | CCR5 (0.46) | CCR5HTTADRA2AADRA2CDRD3 | |
| Fumaric Acid SCHEMBL7462660 | 0.84 | CCR5 (0.46) | CCR5HTTADRA2AADRA2CDRD3 | |
| SCHEMBL8185000 | 0.83 | CHRM2 (0.49) | CCR5HTTCHRM2CHRM1CHRM3 | |
| SCHEMBL7466084 | 0.83 | CYP2J2 (0.52) | CCR5DRD3HTR2B | |
| Hydrochloric Acid SCHEMBL7465772 | 0.83 | CCR5 (0.70) | CCR5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1180513-A1 | CYCLIC AMIDE COMPOUNDS, PROCESS FOR THE PREPARATION OF THE SAME AND USES THEREOF | Takeda Chemical Industries, Ltd. (JP) | 2002-02-20 | — | — | EP | disclosed |