Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 11/20 | 0.55 |
| ▸ | SMO | Q99835 | 1/20 | 0.54 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.53 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.53 |
| ▸ | PARP1 | P09874 | 2/20 | 0.52 |
| ▸ | UBE2T | Q9NPD8 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | KDM1A | O60341 | 1/20 | 0.48 |
| ▸ | JAK2 | O60674 | 1/20 | 0.47 |
| ▸ | JAK1 | P23458 | 1/20 | 0.47 |
| ▸ | JAK3 | P52333 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6894024 | 0.86 | ALDH1A1 (0.59) | SMOPARP1ALDH1A1KMT2A | |
| SCHEMBL7141331 | 0.84 | HRH3 (0.53) | HRH3SMOOPRM1OPRK1PARP1 | |
| SCHEMBL29475033 | 0.84 | UBE2T (0.71) | HRH3SMOOPRM1OPRK1PARP1 | |
| SCHEMBL30289763 | 0.84 | UBE2T (0.71) | HRH3SMOOPRM1OPRK1PARP1 | |
| SCHEMBL4460927 | 0.83 | RAB9A (0.56) | HRH3SMOOPRM1OPRK1PARP1 | |
| Hydrochloric Acid SCHEMBL5010433 | 0.83 | UBE2T (0.69) | HRH3SMOOPRM1OPRK1PARP1 | |
| SCHEMBL30415822 | 0.83 | UBE2T (0.69) | HRH3SMOOPRM1OPRK1PARP1 | |
| SCHEMBL29074197 | 0.83 | UBE2T (0.69) | HRH3SMOOPRM1OPRK1PARP1 | |
| SCHEMBL27739969 | 0.83 | UBE2T (0.69) | HRH3SMOOPRM1OPRK1PARP1 | |
| SCHEMBL6824130 | 0.82 | ALDH1A1 (0.69) | UBE2TALDH1A1KMT2A |
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-2012064569-A1 | IMIDAZOLE DERIVATIVES | MERCK SHARP & DOHME CORP. (US) | 2012-05-18 | — | — | WO | disclosed |