Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 6/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | ALPG | P10696 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | ALPL | P05186 | 1/20 | 0.50 |
| ▸ | ALPI | P09923 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | DAO | P14920 | 1/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL8414058 | 0.88 | CYP1A2 (0.56) | CYP2C19CYP1A2CYP2D6CYP2C9CYP3A4 | |
| SCHEMBL28902097 | 0.84 | CYP2C19 (0.67) | CYP2C19CYP1A2CYP2D6CYP2C9CYP3A4 | |
| SCHEMBL8412649 | 0.82 | CYP3A4 (0.58) | CYP2C19CYP1A2CYP2D6CYP2C9CYP3A4 | |
| SCHEMBL9150145 | 0.81 | CYP3A4 (0.70) | CYP2C19CYP1A2CYP2D6CYP2C9CYP3A4 | |
| SCHEMBL21325965 | 0.81 | CYP1A2 (0.58) | CYP2C19CYP1A2CYP2D6CYP2C9CYP3A4 | |
| SCHEMBL22922266 | 0.78 | CYP1A2 (0.60) | CYP2C19CYP1A2CYP2D6CYP2C9CYP3A4 | |
| Ristianol SCHEMBL10352649 | 0.78 | CYP2C19 (0.60) | CYP2C19CYP1A2CYP2D6CYP2C9CYP3A4 | |
| SCHEMBL9867262 | 0.78 | CYP1A2 (0.60) | CYP2C19CYP1A2CYP2D6CYP2C9CYP3A4 | |
| SCHEMBL18781368 | 0.78 | CYP1A2 (0.60) | CYP2C19CYP1A2CYP2D6CYP2C9CYP3A4 | |
| SCHEMBL934486 | 0.77 | CYP2C19 (0.55) | CYP2C19CYP1A2CYP2D6CYP2C9CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5859030-A | Substituted arylalkylthioalkylthiopyridines for use in the control of helicobacter bacteria | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1999-01-12 | — | — | US | disclosed |
| WO-1996000224-A1 | 4-S- AND N-SUBSTITUTED 6-ALKYLPYRIDINES FOR CONTROLLING HELICOBACTER BACTERIA | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1996-01-04 | — | — | WO | disclosed |