Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 6/20 | 0.39 |
| ▸ | NOS1 | P29475 | 6/20 | 0.39 |
| ▸ | NOS2 | P35228 | 6/20 | 0.39 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.35 |
| ▸ | HRH2 | P25021 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL17730796 | 0.67 | ACHE (0.44) | NOS3NOS1NOS2TSHR | |
| SCHEMBL19656763 | 0.67 | MAPT (0.38) | NOS3NOS1NOS2LIMK1HRH2 | |
| SCHEMBL512854 | 0.67 | HRH3 (0.42) | NOS3NOS1NOS2LIMK1HRH2 | |
| SCHEMBL12294286 | 0.66 | LIMK1 (0.54) | NOS3NOS1NOS2LIMK1HRH2 | |
| SCHEMBL30667152 | 0.64 | LIMK1 (0.39) | NOS3NOS1NOS2LIMK1HRH2 | |
| SCHEMBL31389619 | 0.63 | GAA (0.49) | HRH3TSHR | |
| SCHEMBL19656750 | 0.63 | LMNA (0.38) | NOS3NOS1NOS2LIMK1HRH2 | |
| SCHEMBL18797260 | 0.63 | JAK2 (0.30) | — | |
| SCHEMBL2738615 | 0.62 | HCAR2 (0.32) | NOS3NOS1NOS2LIMK1 | |
| SCHEMBL14386029 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017205296-A1 | AMINOACYLINDAZOLE IMMUNOMODULATORS FOR TREATMENT OF AUTOIMMUNE DISEASES | THE ROCKEFELLER UNIVERSITY (US) | 2017-11-30 | — | — | WO | disclosed |