Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 5/20 | 0.34 |
| ▸ | NOS3 | P29474 | 4/20 | 0.34 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 5/20 | 0.32 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL18489405 | 0.77 | NOS2 (0.37) | NOS1NOS3MBOAT4NOS2 | |
| Hydrochloric Acid SCHEMBL18489417 | 0.75 | NOS2 (0.36) | NOS1NOS3MBOAT4NOS2 | |
| SCHEMBL16389765 | 0.74 | ALDH1A1 (0.36) | NOS1NOS3NOS2 | |
| SCHEMBL17069066 | 0.74 | NOS2 (0.56) | NOS1NOS3MBOAT4NOS2 | |
| SCHEMBL31703186 | 0.70 | KDM4E (0.38) | MBOAT4 | |
| SCHEMBL1162976 | 0.70 | KDM4E (0.38) | MBOAT4 | |
| SCHEMBL2961239 | 0.69 | CTSK (0.41) | NOS1NOS3NOS2 | |
| SCHEMBL9426089 | 0.69 | KDM4E (0.36) | NOS1NOS3NOS2 | |
| SCHEMBL2614502 | 0.69 | NOS3 (0.44) | NOS1NOS3NOS2 | |
| SCHEMBL17707922 | 0.67 | NOS3 (0.55) | NOS1NOS3NOS2 |
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-2017027343-A1 | CGRP RECEPTOR ANTAGONISTS | ELI LILLY AND COMPANY (US) | 2017-02-16 | — | — | WO | disclosed |