Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 18/20 | 1.00 |
| ▸ | NOS3 | P29474 | 16/20 | 1.00 |
| ▸ | NOS2 | P35228 | 16/20 | 1.00 |
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 | |
|---|---|---|---|---|
| SCHEMBL1387463 | 0.82 | NOS1 (1.00) | NOS1NOS3NOS2 | |
| Iodide SCHEMBL7787922 | 0.81 | NOS1 (1.00) | NOS1NOS3NOS2 | |
| SCHEMBL4987214 | 0.81 | NOS3 (0.67) | NOS1NOS3NOS2 | |
| SCHEMBL1387776 | 0.80 | NOS1 (1.00) | NOS1NOS3NOS2 | |
| SCHEMBL21067846 | 0.80 | NOS1 (1.00) | NOS1NOS3NOS2 | |
| Iodide SCHEMBL11683524 | 0.78 | NOS1 (1.00) | NOS1NOS3NOS2 | |
| Bromide SCHEMBL11804676 | 0.78 | NOS1 (0.96) | NOS1NOS3NOS2 | |
| SCHEMBL7787974 | 0.77 | NOS3 (1.00) | NOS1NOS3NOS2 | |
| SCHEMBL7788121 | 0.75 | NOS1 (1.00) | NOS1NOS3NOS2 | |
| SCHEMBL4987178 | 0.74 | NOS3 (0.59) | 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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-H09504278-A | — | — | 1997-04-28 | — | — | JP | claimed |
| 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 |
| US-6297276-B1 | Substituted urea and isothiourea derivatives as no synthase inhibitors | GLAXOSMITHKLINE | 2001-10-02 | — | — | US | disclosed |
| US-6225305-B1 | Substituted urea and isothiorea derivatives as no synthase inhibitors | GLAXO WELLCOME INC. | 2001-05-01 | — | — | US | disclosed |
| US-6090846-A | ADMINISTERING S-ETHYL-N-((4-TRIFLUOROMETHYL)PHENYL)ISOTHIOUREA | GLAXO WELLCOME INC. (US) | 2000-07-18 | — | — | US | disclosed |
| EP-0723438-A1 | SUBSTITUTED UREA AND ISOTHIOUREA DERIVATIVES AS NO SYNTHASE INHIBITORS | THE WELLCOME FOUNDATION LIMITED (GB) | 1996-07-31 | — | — | EP | disclosed |
| WO-1995009619-A2 | SUBSTITUTED UREA AND ISOTHIOUREA DERIVATIVES AS NO SYNTHASE INHIBITORS | THE WELLCOME FOUNDATION LIMITED (GB) | 1995-04-13 | — | — | WO | disclosed |