Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | OTC | P00480 | 1/20 | 0.43 |
| ▸ | NOS3 | P29474 | 4/20 | 0.38 |
| ▸ | NOS1 | P29475 | 4/20 | 0.38 |
| ▸ | NOS2 | P35228 | 3/20 | 0.38 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.38 |
| ▸ | GSR | P00390 | 1/20 | 0.36 |
| ▸ | NOD1 | Q9Y239 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | THPO | P40225 | 1/20 | 0.35 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.34 |
| ▸ | BHMT | Q93088 | 1/20 | 0.34 |
| ▸ | BHMT2 | Q9H2M3 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ARG1 | P05089 | 1/20 | 0.33 |
| ▸ | ARG2 | P78540 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9066333 | 1.00 | PMP22 (0.43) | PMP22OTCNOS3NOS1NOS2 | |
| SCHEMBL7787865 | 0.84 | OTC (0.48) | OTCNOS3NOS1NOS2DDAH1 | |
| SCHEMBL7787862 | 0.84 | OTC (0.48) | OTCNOS3NOS1NOS2DDAH1 | |
| SCHEMBL7785336 | 0.80 | GSR (0.43) | OTCNOS3NOS1NOS2GSR | |
| SCHEMBL7789549 | 0.80 | GSR (0.43) | OTCNOS3NOS1NOS2GSR | |
| Thiocitrulline SCHEMBL8271436 | 0.78 | OTC (0.50) | PMP22OTCNOS3NOS1NOS2 | |
| S-Methyl-D-Thiocitrulline SCHEMBL7787855 | 0.78 | OTC (0.50) | PMP22OTCNOS3NOS1NOS2 | |
| Arginine SCHEMBL6468371 | 0.77 | PMP22 (0.50) | PMP22OTCNOS3NOS1NOS2 | |
| Arginine SCHEMBL17874428 | 0.77 | PMP22 (0.50) | PMP22OTCNOS3NOS1NOS2 | |
| Arginine SCHEMBL6468370 | 0.77 | PMP22 (0.50) | PMP22OTCNOS3NOS1NOS2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0723438-A1 | SUBSTITUTED UREA AND ISOTHIOUREA DERIVATIVES AS NO SYNTHASE INHIBITORS | THE WELLCOME FOUNDATION LIMITED (GB) | 1996-07-31 | — | — | EP | claimed |
| WO-1995009619-A2 | SUBSTITUTED UREA AND ISOTHIOUREA DERIVATIVES AS NO SYNTHASE INHIBITORS | THE WELLCOME FOUNDATION LIMITED (GB) | 1995-04-13 | — | — | WO | claimed |