Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 6/20 | 0.59 |
| ▸ | NOS2 | P35228 | 5/20 | 0.59 |
| ▸ | NOS3 | P29474 | 5/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | QRFPR | Q96P65 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL6599781 | 1.00 | NOS1 (0.59) | NOS1NOS2NOS3HTTSMN1; SMN2 | |
| SCHEMBL5394573 | 0.85 | NOS2 (0.52) | NOS1NOS2NOS3HTTSMN1; SMN2 | |
| SCHEMBL5394577 | 0.85 | NOS2 (0.52) | NOS1NOS2NOS3HTTSMN1; SMN2 | |
| SCHEMBL5380798 | 0.84 | NOS3 (0.62) | NOS1NOS2NOS3QRFPR | |
| SCHEMBL5380791 | 0.84 | NOS3 (0.62) | NOS1NOS2NOS3QRFPR | |
| SCHEMBL7599402 | 0.83 | NOS3 (0.61) | NOS1NOS2NOS3QRFPR | |
| Hydrochloric Acid SCHEMBL7602393 | 0.82 | NOS3 (0.60) | NOS1NOS2NOS3QRFPR | |
| SCHEMBL5382776 | 0.82 | NOS1 (0.54) | NOS1NOS2NOS3QRFPR | |
| SCHEMBL5382768 | 0.82 | NOS1 (0.54) | NOS1NOS2NOS3QRFPR | |
| SCHEMBL6600980 | 0.81 | NOS1 (0.52) | NOS1NOS2NOS3QRFPRKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-1265891-B1 | NOVEL LIPOIC ACID HETEROCYCLIC OR BENZENE DERIVATIVES, PREPARATION AND USE THEREOF AS MEDICINES | CONSEILS DE RECH SET D APPLIC (FR) | 2004-12-29 | — | — | EP | disclosed |