Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 11/20 | 1.00 |
| ▸ | NOS3 | P29474 | 2/20 | 0.43 |
| ▸ | NOS1 | P29475 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9705757 | 1.00 | NOS2 (1.00) | NOS2NOS3NOS1 | |
| Cyclopropanecarboximidamide SCHEMBL1221622 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL9292761 | 0.96 | NOS2 (0.93) | NOS2NOS3NOS1 | |
| Cyclopropanecarboximidamide SCHEMBL275450 | 0.96 | — | — | |
| Hydrochloric Acid SCHEMBL9292759 | 0.96 | NOS2 (0.93) | NOS2NOS3NOS1 | |
| Cyclopropanecarboximidamide SCHEMBL25215941 | 0.96 | — | — | |
| Cyclopropanecarboximidamide SCHEMBL17376368 | 0.93 | — | — | |
| SCHEMBL20041277 | 0.87 | NOS2 (0.77) | NOS2NOS3NOS1 | |
| Cyclopropanecarboximidamide SCHEMBL6621298 | 0.87 | NOS2 (0.77) | NOS2NOS3NOS1 | |
| SCHEMBL11568588 | 0.87 | NOS2 (0.77) | NOS2NOS3NOS1 |
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-1992012218-A1 | PYRIMIDINECYCLOHEXANE DERIVATIVES, A METHOD OF PREPARING THEM AND THEIR USE IN LIQUID-CRYSTALLINE MIXTURES | HOECHST AKTIENGESELLSCHAFT (DE) | 1992-07-23 | — | — | WO | disclosed |