Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | REN | P00797 | 9/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | DHODH | Q02127 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HRH2 | P25021 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1751975 | 0.89 | CYP3A4 (0.42) | CYP3A4RENCHRM5CHRM1KDM4E | |
| SCHEMBL1751338 | 0.80 | CYP3A4 (0.41) | CYP3A4RENCHRM5CHRM1 | |
| SCHEMBL2635400 | 0.80 | CYP3A4 (0.63) | CYP3A4RENDHODH | |
| SCHEMBL2781108 | 0.78 | CHRM5 (0.42) | CHRM5CHRM1SMN1; SMN2PPARGPPARA | |
| SCHEMBL1751769 | 0.77 | ESR2 (0.39) | KDM4ELMNASMN1; SMN2 | |
| SCHEMBL5941966 | 0.75 | ESR2 (0.39) | CHRM5CHRM1KDM4EPPARGPPARA | |
| SCHEMBL695344 | 0.73 | PKM (0.57) | KDM4EALDH1A1 | |
| SCHEMBL10369976 | 0.70 | CHRM2 (0.46) | CHRM5CHRM1 | |
| SCHEMBL5941452 | 0.69 | CYP3A4 (0.52) | CYP3A4REN | |
| SCHEMBL2634957 | 0.69 | REN (0.54) | CYP3A4REN |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1981847-A1 | SECONDARY AMINES AS RENIN INHIBITORS | Actelion Pharmaceuticals Ltd. (CH) | 2008-10-22 | — | — | EP | disclosed |
| WO-2007088514-A1 | SECONDARY AMINES AS RENIN INHIBITORS | ACTELION PHARMACEUTICALS LTD (CH) | 2007-08-09 | — | — | WO | disclosed |