Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 6/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.39 |
| ▸ | CDC42BPB | Q9Y5S2 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.37 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.36 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.36 |
| ▸ | NMT1 | P30419 | 2/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8106931 | 0.75 | OPRL1 (0.45) | OPRL1ROCK2ROCK1CDC42BPBMAP4K1 | |
| SCHEMBL8059824 | 0.74 | OPRL1 (0.44) | OPRL1ROCK2ROCK1CDC42BPBMAP4K1 | |
| SCHEMBL8075644 | 0.74 | ADORA2A (0.43) | ROCK2ROCK1CDC42BPBADORA2AADORA1 | |
| SCHEMBL8071108 | 0.73 | MAP4K1 (0.39) | ROCK2ROCK1CDC42BPBADORA2AADORA1 | |
| SCHEMBL8071080 | 0.71 | EGLN1 (0.52) | OPRL1 | |
| SCHEMBL8070777 | 0.71 | EGLN1 (0.52) | OPRL1 | |
| SCHEMBL8069366 | 0.70 | OPRL1 (0.66) | OPRL1 | |
| SCHEMBL8074378 | 0.69 | OPRL1 (0.46) | OPRL1 | |
| SCHEMBL2935652 | 0.69 | CHRNB4 (0.43) | ROCK2ROCK1CDC42BPBADORA2AADORA1 | |
| SCHEMBL8069092 | 0.69 | OPRL1 (0.57) | OPRL1CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6051570-A | ANTIULCER AGENTS | DR. REDDY'S RESEARCH FOUNDATION (IN) | 2000-04-18 | — | — | US | disclosed |
| EP-0983263-A1 | NOVEL BENZIMIDAZOLE DERIVATIVES AS ANTIULCER AGENTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | DR. REDDY'S RESEARCH FOUNDATION (IN) | 2000-03-08 | — | — | EP | disclosed |
| WO-1998054172-A1 | NOVEL BENZIMIDAZOLE DERIVATIVES AS ANTIULCER AGENTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | DR. REDDY'S RESEARCH FOUNDATION (IN) | 1998-12-03 | — | — | WO | disclosed |