Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | SMYD2 | Q9NRG4 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | PRNP | P04156 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.32 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6633064 | 1.00 | CYP3A4 (0.35) | CYP3A4HTTSMN1; SMN2SMYD2POLB | |
| SCHEMBL8629908 | 0.89 | ACE (0.39) | CYP3A4HTTSMN1; SMN2SMYD2ADRB2 | |
| SCHEMBL8629904 | 0.89 | ACE (0.39) | CYP3A4HTTSMN1; SMN2SMYD2ADRB2 | |
| SCHEMBL5685142 | 0.85 | ESRRB (0.39) | CYP3A4HTTSMN1; SMN2SMYD2ABL1 | |
| SCHEMBL5685150 | 0.85 | ESRRB (0.39) | CYP3A4HTTSMN1; SMN2SMYD2ABL1 | |
| SCHEMBL5873084 | 0.85 | ESRRB (0.39) | CYP3A4HTTSMN1; SMN2SMYD2ABL1 | |
| SCHEMBL4706102 | 0.83 | APAF1 (0.37) | CYP3A4HTTSMN1; SMN2SMYD2POLB | |
| SCHEMBL451543 | 0.83 | APAF1 (0.37) | CYP3A4HTTSMN1; SMN2SMYD2POLB | |
| Hydrochloric Acid SCHEMBL4708235 | 0.83 | APAF1 (0.37) | CYP3A4HTTSMN1; SMN2SMYD2POLB | |
| Hydrochloric Acid SCHEMBL4708232 | 0.83 | APAF1 (0.37) | CYP3A4HTTSMN1; SMN2SMYD2POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0818447-B1 | 6-(Hydroxymethyl-ethyl)pyridines as HMG-CoA-reductase inhibitors | BAYER HEALTHCARE AG (DE) | 2004-05-26 | — | — | EP | disclosed |
| US-5849749-A | 6-(hydroxymethyl-ethyl)pyridines | BAYER AKTIENGESELLSCHAFT (DE) | 1998-12-15 | — | — | US | disclosed |
| EP-0818447-A1 | 6-(Hydroxymethyl-ethyl)pyridines as HMG-CoA-reductase inhibitors | BAYER AG (DE) | 1998-01-14 | — | — | EP | disclosed |