Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.42 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.42 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 12/20 | 0.35 |
| ▸ | CA2 | P00918 | 12/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | F10 | P00742 | 1/20 | 0.33 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL13850904 | 0.89 | NOS3 (0.39) | ITGB3ITGA2BNOS3NOS1NOS2 | |
| SCHEMBL4093905 | 0.83 | NOS3 (0.45) | ITGB3ITGA2BNOS3NOS1NOS2 | |
| SCHEMBL19670823 | 0.81 | MAPT (0.40) | ITGB3ITGA2BNOS3NOS1NOS2 | |
| SCHEMBL25515864 | 0.81 | CA1 (0.34) | ITGB3ITGA2BNOS3NOS1NOS2 | |
| SCHEMBL16540241 | 0.81 | NOS3 (0.37) | ITGB3ITGA2BNOS3NOS1NOS2 | |
| SCHEMBL18119733 | 0.80 | NOS3 (0.46) | ITGB3ITGA2BNOS3NOS1NOS2 | |
| SCHEMBL18119735 | 0.80 | NOS3 (0.36) | ITGB3ITGA2BNOS3NOS1NOS2 | |
| SCHEMBL18121928 | 0.80 | NOS3 (0.43) | ITGB3ITGA2BNOS3NOS1NOS2 | |
| SCHEMBL3812152 | 0.79 | NOS3 (0.39) | NOS3NOS1NOS2CA1CA2 | |
| SCHEMBL13850903 | 0.79 | ALDH1A1 (0.39) | NOS3NOS1NOS2LMNACA1 |
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-20080254198-A1 | Method of Preparing Creatine Ester Salts and Uses Thereof | BIO-ENGINEERED SUPPLEMENTS & NUTRITION, INC. (US) | 2008-10-16 | — | — | US | claimed |