Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | ALB | P02768 | 1/20 | 0.44 |
| ▸ | RORC | P51449 | 8/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7386806 | 0.83 | PCSK9 (0.49) | PCSK9CHRM1RORCCYP3A4CYP2C9 | |
| SCHEMBL1094507 | 0.81 | CDK2 (0.46) | RORCCYP3A4CYP2C9POLBKDM4E | |
| SCHEMBL28831936 | 0.80 | CDK2 (0.47) | RORCCYP3A4CYP2C9POLBKDM4E | |
| SCHEMBL29209764 | 0.80 | PRNP (0.45) | POLBKDM4ELMNAHTTBRD4 | |
| SCHEMBL12484211 | 0.80 | CHRM1 (0.53) | PCSK9CHRM1ALBRORCCYP3A4 | |
| SCHEMBL23809344 | 0.78 | NOTUM (0.40) | CYP3A4POLBKDM4ELMNABRD4 | |
| SCHEMBL1983582 | 0.77 | CNR2 (0.49) | PCSK9CHRM1RORCCNR1CNR2 | |
| SCHEMBL2041249 | 0.75 | CHRM1 (0.46) | PCSK9CHRM1RORCCYP3A4CYP2C9 | |
| SCHEMBL9796473 | 0.75 | PCSK9 (0.41) | PCSK9CHRM1CNR1CNR2HTT | |
| SCHEMBL21392215 | 0.74 | GSK3B (0.43) | PCSK9LMNA |
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-2012114252-A1 | NOVEL INDOLE AND PYRROLOPYRIDINE AMIDES | ACTELION PHARMACEUTICALS LTD (CH) | 2012-08-30 | — | — | WO | disclosed |
| US-5026722-A | Antagonists of 5-hydroxytryptamine | GLAXO GROUP LIMITED (GB) | 1991-06-25 | — | — | US | disclosed |
| EP-0347229-A1 | Indole derivatives | GLAXO GROUP LIMITED (GB) | 1989-12-20 | — | — | EP | disclosed |