Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 19/20 | 0.64 |
| ▸ | CHRNA4 | P43681 | 19/20 | 0.64 |
| ▸ | CHRNA3 | P32297 | 18/20 | 0.64 |
| ▸ | CHRNB4 | P30926 | 17/20 | 0.64 |
| ▸ | CHRNA7 | P36544 | 16/20 | 0.64 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.59 |
| ▸ | CHRNA6 | Q15825 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL1710983 | 1.00 | CHRNB2 (0.64) | CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7 | |
| SCHEMBL1711288 | 1.00 | CHRNB2 (0.64) | CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7 | |
| SCHEMBL18828709 | 0.85 | CHRNB2 (0.56) | CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7 | |
| SCHEMBL3240417 | 0.83 | CHRNB2 (0.52) | CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7 | |
| SCHEMBL3363292 | 0.82 | CHRNB2 (0.66) | CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7 | |
| SCHEMBL3333418 | 0.82 | CHRNB2 (0.66) | CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7 | |
| SCHEMBL31630839 | 0.82 | CHRNB2 (0.66) | CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7 | |
| SCHEMBL1711422 | 0.80 | CHRNB2 (0.67) | CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7 | |
| SCHEMBL1711502 | 0.80 | CHRNB2 (0.67) | CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7 | |
| SCHEMBL14804553 | 0.80 | CHRNB2 (0.58) | CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8623857-B2 | N-phenyl imidazole carboxamide inhibitors of 3-phosphoinositide-dependent protein kinase-1 | MERCK SHARP & DOHME CORP. (US) | 2014-01-07 | — | — | US | disclosed |