Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 14/20 | 0.51 |
| ▸ | CTSS | P25774 | 11/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.44 |
| ▸ | NOS3 | P29474 | 1/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.42 |
| ▸ | NOS2 | P35228 | 1/20 | 0.42 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18517735 | 0.88 | CTSK (0.47) | CTSKCTSSHPGDSMN1; SMN2CYP19A1 | |
| SCHEMBL7219740 | 0.88 | NOS2 (0.46) | CTSKCTSSCYP19A1NOS2 | |
| SCHEMBL7215604 | 0.82 | CYP2A6 (0.43) | CTSKCTSSCYP19A1NOS3NOS2 | |
| SCHEMBL7219031 | 0.76 | KDM4E (0.49) | CTSKCTSSHPGDSMN1; SMN2CYP19A1 | |
| SCHEMBL24017195 | 0.73 | CYP2A6 (0.43) | CTSKCTSSCYP19A1NOS3NOS1 | |
| SCHEMBL9564934 | 0.73 | NOTUM (0.41) | — | |
| SCHEMBL9066621 | 0.72 | NOS2 (0.48) | CTSKCTSSHPGDSMN1; SMN2NOS3 | |
| SCHEMBL13964656 | 0.71 | CTSK (0.43) | CTSKCTSSNOS3NOS1NOS2 | |
| SCHEMBL4453992 | 0.71 | CTSK (0.58) | CTSKCTSS | |
| SCHEMBL1425076 | 0.71 | GRM5 (0.39) | NOS3NOS2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6603007-B1 | Intermediates in the fields of pharmaceuticals, agrichemicals, ligands, silver halide photosensitive materials, liquid crystals, surfactants, electrophotography and organic electroluminescence | SANKIO CHEMICAL CO., LTD. (JP) | 2003-08-05 | — | — | US | disclosed |
| EP-1231207-A1 | NOVEL BIPYRIDYL DERIVATIVES | Sankio Chemical Co., Ltd. (JP) | 2002-08-14 | — | — | EP | disclosed |