Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRS3 | P32247 | 2/20 | 0.59 |
| ▸ | OPRL1 | P41146 | 13/20 | 0.51 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | WDR5 | P61964 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.37 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.37 |
| ▸ | ATP1A1 | P05023 | 1/20 | 0.37 |
| ▸ | ATP1B1 | P05026 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8061857 | 0.92 | OPRL1 (0.60) | BRS3OPRL1ALDH1A1TSHRCYP2C9 | |
| SCHEMBL8059921 | 0.85 | BRS3 (0.51) | BRS3OPRL1ALDH1A1TSHRKDM4E | |
| SCHEMBL8075357 | 0.84 | OPRL1 (0.53) | BRS3OPRL1CYP2C9ATP1A1ATP1B1 | |
| SCHEMBL8060096 | 0.84 | OPRL1 (0.53) | BRS3OPRL1CYP2C9ATP1A1ATP1B1 | |
| SCHEMBL8071079 | 0.83 | OPRL1 (0.58) | BRS3OPRL1ALDH1A1TSHREGLN1 | |
| SCHEMBL8072215 | 0.83 | OPRL1 (0.54) | BRS3OPRL1CYP2C9ATP1A1ATP1B1 | |
| SCHEMBL8074070 | 0.82 | BRS3 (0.58) | BRS3OPRL1ALDH1A1CYP2C9WDR5 | |
| SCHEMBL8060015 | 0.81 | PDE10A (0.40) | BRS3OPRL1PDE10AALDH1A1EGLN1 | |
| SCHEMBL8070545 | 0.78 | NPC1 (0.62) | BRS3OPRL1ALDH1A1TSHRCYP2C9 | |
| SCHEMBL9784719 | 0.76 | BRS3 (0.67) | BRS3ALDH1A1CYP2C9WDR5KMT2A |
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 4 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 | claimed |
| 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 |