Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 11/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA5A | P35218 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6841895 | 0.98 | CCR5 (0.53) | CCR5HRH3KCNH2CA12CA1 | |
| SCHEMBL2916843 | 0.91 | CCR5 (0.57) | CCR5HRH3KCNH2PTGDR2 | |
| SCHEMBL2910485 | 0.89 | CCR5 (0.65) | CCR5HRH3KCNH2 | |
| Hydrochloric Acid SCHEMBL2917628 | 0.88 | CCR5 (0.64) | CCR5HRH3KCNH2 | |
| SCHEMBL2911935 | 0.84 | CCR5 (0.51) | CCR5HRH3KCNH2 | |
| SCHEMBL2909666 | 0.83 | CCR5 (0.60) | CCR5HRH3KCNH2 | |
| SCHEMBL2916232 | 0.83 | CCR5 (0.52) | CCR5HRH3KCNH2PTGDR2 | |
| SCHEMBL3038072 | 0.82 | CCR5 (0.67) | CCR5HRH3KCNH2 | |
| Hydrochloric Acid SCHEMBL2910989 | 0.82 | CCR5 (0.59) | CCR5HRH3KCNH2 | |
| SCHEMBL2909484 | 0.82 | CCR5 (0.55) | CCR5HRH3KCNH2PTGDR2 |
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-1430027-B1 | NOVEL AMINOAZETIDINE, -PYRROLIDINE AND -PIPERIDINE DERIVATIVES | HIGH POINT PHARMACEUTICALS LLC (US) | 2010-09-01 | — | — | EP | claimed |