Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.63 |
| ▸ | ACHE | P22303 | 1/20 | 0.63 |
| ▸ | HTR3A | P46098 | 3/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 15/20 | 0.51 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.51 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.47 |
| ▸ | HRH1 | P35367 | 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 | |
|---|---|---|---|---|
| SCHEMBL1983605 | 0.85 | CHEK1 (0.61) | CHEK1ACHEHTR3AHRH3KCNH2 | |
| SCHEMBL1559851 | 0.83 | CHEK1 (0.63) | CHEK1ACHEHRH3KCNH2HRH1 | |
| SCHEMBL1980500 | 0.78 | PIM1 (0.49) | CHEK1ACHE | |
| SCHEMBL1893929 | 0.77 | CHEK1 (1.00) | CHEK1ACHE | |
| SCHEMBL1561131 | 0.76 | CHEK1 (0.75) | CHEK1ACHEHTR3AHRH3KCNH2 | |
| SCHEMBL1978967 | 0.76 | PIM1 (0.61) | CHEK1ACHE | |
| SCHEMBL1793223 | 0.75 | HRH3 (0.60) | ACHEHRH3KCNH2HRH1 | |
| SCHEMBL12666765 | 0.74 | CHEK1 (0.74) | CHEK1ACHE | |
| SCHEMBL1798410 | 0.74 | HRH3 (0.58) | ACHEHRH3KCNH2HRH1 | |
| SCHEMBL1981543 | 0.74 | PIM1 (0.49) | CHEK1ACHE |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011070298-A1 | DI-SUBSTITUTED 9H-PYRIDO[3,4-B]INDOLE DERIVATIVES, PREPARATION OF SAME AND THERAPEUTIC USE THEREOF | SANOFI-AVENTIS (FR) | 2011-06-16 | — | — | WO | claimed |
| WO-2011070298-A1 | DI-SUBSTITUTED 9H-PYRIDO[3,4-B]INDOLE DERIVATIVES, PREPARATION OF SAME AND THERAPEUTIC USE THEREOF | SANOFI-AVENTIS (FR) | 2011-06-16 | — | — | WO | disclosed |
| WO-2011070298-A1 | DI-SUBSTITUTED 9H-PYRIDO[3,4-B]INDOLE DERIVATIVES, PREPARATION OF SAME AND THERAPEUTIC USE THEREOF | SANOFI-AVENTIS (FR) | 2011-06-16 | — | — | WO | disclosed |