Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8724347 | 0.74 | CYP3A4 (0.45) | KDM4EALDH1A1HTTHSD17B10CYP3A4 | |
| SCHEMBL8721411 | 0.70 | TSHR (0.51) | ALDH1A1HTTHSD17B10CYP3A4 | |
| SCHEMBL8726118 | 0.69 | CYP3A4 (0.45) | KDM4EALDH1A1HTTHSD17B10CYP3A4 | |
| SCHEMBL8721420 | 0.69 | CYP17A1 (0.40) | CYP3A4 | |
| SCHEMBL8724044 | 0.69 | CYP11B1 (0.39) | KDM4EALDH1A1HSD17B10CYP3A4 | |
| SCHEMBL8720894 | 0.68 | MAPK8 (0.33) | CYP3A4 | |
| SCHEMBL8720924 | 0.66 | CYP3A4 (0.38) | KDM4EALDH1A1HTTHSD17B10CYP3A4 | |
| SCHEMBL8724187 | 0.66 | CYP3A4 (0.35) | KDM4EALDH1A1HTTHSD17B10CYP3A4 | |
| SCHEMBL8724368 | 0.64 | CYP11B2 (0.44) | KDM4EALDH1A1HTTHSD17B10CYP3A4 | |
| SCHEMBL2073935 | 0.63 | CYP11B2 (0.42) | KDM4EALDH1A1HTTHSD17B10CYP3A4 |
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-1998000430-A1 | IMIDAZOL DERIVATIVES USEFUL AS NITROGEN MONOXIDE SYNTHASE INHIBITORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1998-01-08 | — | — | WO | disclosed |