Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 2/20 | 0.61 |
| ▸ | NOS1 | P29475 | 2/20 | 0.61 |
| ▸ | NOS2 | P35228 | 2/20 | 0.61 |
| ▸ | LPAR3 | Q9UBY5 | 9/20 | 0.53 |
| ▸ | LPAR2 | Q9HBW0 | 7/20 | 0.53 |
| ▸ | LPAR1 | Q92633 | 4/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HRH2 | P25021 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2790028 | 0.90 | NOS3 (0.61) | NOS3NOS1NOS2LPAR3LPAR2 | |
| Hydrazine SCHEMBL11325087 | 0.78 | LPAR3 (0.75) | LPAR3LPAR2LPAR1CYP3A4 | |
| SCHEMBL28747383 | 0.78 | LPAR3 (0.82) | LPAR3LPAR2LPAR1CYP3A4 | |
| SCHEMBL55728 | 0.78 | — | — | |
| SCHEMBL6562227 | 0.78 | — | — | |
| Guanidine SCHEMBL27923976 | 0.78 | LPAR3 (0.81) | LPAR3LPAR2LPAR1CYP3A4 | |
| Ethylenediamine SCHEMBL3262124 | 0.77 | LPAR3 (0.72) | LPAR3LPAR2LPAR1CYP3A4 | |
| Ammonia Solution, Strong SCHEMBL8824375 | 0.76 | LPAR3 (0.78) | LPAR3LPAR2LPAR1CYP3A4 | |
| Ammonia Solution, Strong SCHEMBL4299244 | 0.76 | LPAR3 (0.78) | LPAR3LPAR2LPAR1CYP3A4 | |
| SCHEMBL9584435 | 0.76 | LPAR3 (0.78) | LPAR3LPAR2LPAR1CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0928191-B1 | PHARMACEUTICAL COMPOSITIONS COMPRISING S-ALKYLISOTHIOURONIUM DERIVATIVES | MEDITOR PHARMACEUTICALS LTD (IL) | 2002-08-28 | — | — | EP | disclosed |
| EP-0928191-A1 | PHARMACEUTICAL COMPOSITIONS COMPRISING S-ALKYLISOTHIOURONIUM DERIVATIVES | Meditor Pharmaceuticals Ltd. (IL) | 1999-07-14 | — | — | EP | disclosed |
| WO-1998013036-A1 | PHARMACEUTICAL COMPOSITIONS COMPRISING S-ALKYLISOTHIOURONIUM DERIVATIVES | MEDITOR PHARMACEUTICALS LTD. (IL) | 1998-04-02 | — | — | WO | disclosed |