Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 4/20 | 0.61 |
| ▸ | ACHE | P22303 | 4/20 | 0.61 |
| ▸ | HTR3A | P46098 | 3/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 10/20 | 0.51 |
| ▸ | HRH1 | P35367 | 2/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | FLT1 | P17948 | 1/20 | 0.47 |
| ▸ | FLT4 | P35916 | 1/20 | 0.47 |
| ▸ | KDR | P35968 | 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 | |
|---|---|---|---|---|
| SCHEMBL1561131 | 0.91 | CHEK1 (0.75) | CHEK1ACHEHTR3AHRH3HRH1 | |
| SCHEMBL1979641 | 0.85 | CHEK1 (0.63) | CHEK1ACHEHTR3AHRH3HRH1 | |
| SCHEMBL1980317 | 0.84 | PDPK1 (0.49) | CHEK1ACHEHTR3AHRH3HRH1 | |
| SCHEMBL2217947 | 0.82 | CHEK1 (0.62) | CHEK1ACHEHRH3 | |
| SCHEMBL4094281 | 0.81 | HRH3 (0.72) | HRH3HRH1KCNH2CYP2D6FLT1 | |
| SCHEMBL1561210 | 0.80 | CHEK1 (0.59) | CHEK1ACHEHTR3AHRH3HRH1 | |
| SCHEMBL2217331 | 0.79 | CHEK1 (0.62) | CHEK1ACHE | |
| SCHEMBL1983423 | 0.79 | ABL1 (0.47) | CHEK1ACHEFLT1FLT4KDR | |
| SCHEMBL1559853 | 0.78 | ACHE (0.53) | CHEK1ACHEHRH3HRH1SIGMAR1 | |
| SCHEMBL1984242 | 0.78 | EPHX2 (0.46) | CHEK1ACHEHRH3CYP2D6 |
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 2 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 |