Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LIMK1 | P53667 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL24409449 | 0.83 | NUDT1 (0.32) | NUDT1ADORA2AADORA1HTTLMNA | |
| SCHEMBL26317506 | 0.81 | — | — | |
| SCHEMBL19864857 | 0.74 | LIMK1 (0.33) | LIMK1L3MBTL1NOS3NOS2NUDT1 | |
| SCHEMBL22676747 | 0.72 | LIMK1 (0.34) | LIMK1L3MBTL1NOS3NOS2NUDT1 | |
| SCHEMBL26348604 | 0.71 | PDPK1 (0.35) | — | |
| SCHEMBL7519562 | 0.70 | — | — | |
| SCHEMBL13893537 | 0.68 | CHEK1 (0.37) | NUDT1LMNA | |
| SCHEMBL22651230 | 0.67 | ADORA2A (0.33) | LIMK1L3MBTL1ADORA2AADORA1HTT | |
| SCHEMBL27254784 | 0.67 | NUDT1 (0.31) | NUDT1LMNA | |
| SCHEMBL18665428 | 0.66 | NUDT1 (0.30) | NUDT1 |
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-2018049127-A1 | 1,2-DITHIOLANE COMPOUNDS USEFUL IN NEUROPROTECTION, AUTOIMMUNE AND CANCER DISEASES AND CONDITIONS | SABILA BIOSCIENCES LLC (US) | 2018-03-15 | — | — | WO | disclosed |