Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 2/20 | 0.48 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.33 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL172667 | 0.98 | SHBG (0.52) | SHBGCHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL17835196 | 0.98 | SHBG (0.52) | SHBGCHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL12965962 | 0.90 | — | — | |
| SCHEMBL12443366 | 0.90 | — | — | |
| SCHEMBL12443364 | 0.90 | — | — | |
| SCHEMBL13999389 | 0.79 | SHBG (0.43) | SHBGCHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL14612281 | 0.79 | SHBG (0.43) | SHBGCHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL13999841 | 0.79 | SHBG (0.43) | SHBGCHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL25058914 | 0.78 | CHRNB2 (0.39) | SHBGCHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL170931 | 0.78 | SHBG (0.46) | SHBGEPHX1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1255738-B1 | GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO | NEUROCRINE BIOSCIENCES INC (US) | 2012-03-07 | — | — | EP | disclosed |