Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 10/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 10/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 9/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 9/20 | 0.32 |
| ▸ | CD63 | P08962 | 1/20 | 0.32 |
| ▸ | SYK | P43405 | 1/20 | 0.32 |
| ▸ | SSTR2 | P30874 | 1/20 | 0.31 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.31 |
| ▸ | HTR6 | P50406 | 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 | |
|---|---|---|---|---|
| SCHEMBL28076403 | 0.82 | CHRNB2 (0.35) | NOS3NOS1CHRNB4CHRNA3CHRNB2 | |
| SCHEMBL27866883 | 0.82 | CHRNB4 (0.34) | NOS3NOS1CHRNB4CHRNA3CHRNB2 | |
| SCHEMBL27970513 | 0.79 | ADRA2C (0.46) | — | |
| SCHEMBL24533959 | 0.78 | CHRNB2 (0.40) | CHRNB4CHRNA3CHRNB2CHRNA4SSTR2 | |
| SCHEMBL2711961 | 0.76 | NOS3 (0.49) | NOS3NOS1CHRNB2CHRNA4CD63 | |
| Hydrochloric Acid SCHEMBL2195037 | 0.74 | NOS3 (0.48) | NOS3NOS1CHRNB2CHRNA4CD63 | |
| SCHEMBL27910746 | 0.73 | CHRNB2 (0.36) | NOS3NOS1CHRNB4CHRNA3CHRNB2 | |
| SCHEMBL17796709 | 0.71 | CCR6 (0.42) | CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL23707244 | 0.71 | CCR6 (0.42) | CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL28334258 | 0.71 | GRIN2D (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-102625799-A | Heterocyclic compounds and their uses | AMGEN INC | 2012-08-01 | — | — | CN | disclosed |