Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 2/20 | 0.32 |
| ▸ | NOS2 | P35228 | 2/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7599113 | 0.91 | CYP1A2 (0.40) | CYP1A2DPP4NOS1NOS2 | |
| SCHEMBL7593982 | 0.90 | CYP1A2 (0.32) | CYP1A2NOS1NOS2 | |
| SCHEMBL7598038 | 0.88 | CYP1A2 (0.33) | CYP1A2DPP4NOS1NOS2 | |
| SCHEMBL7597043 | 0.86 | CYP1A2 (0.36) | CYP1A2DPP4NOS1NOS2 | |
| SCHEMBL7595030 | 0.86 | CA1 (0.38) | NOS1NOS2 | |
| SCHEMBL7598163 | 0.81 | CYP1A2 (0.35) | CYP1A2DPP4NOS1NOS2 | |
| SCHEMBL7590915 | 0.77 | CA1 (0.45) | NOS1NOS2 | |
| SCHEMBL7593041 | 0.74 | NOS1 (0.33) | NOS1NOS2 | |
| SCHEMBL7599365 | 0.72 | CA1 (0.41) | NOS1NOS2 | |
| SCHEMBL7593257 | 0.72 | CYP1A2 (0.43) | CYP1A2DPP4NOS1NOS2 |
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-0894802-B1 | Silane compound | NIPPON MITSUBISHI OIL CORP (JP) | 2002-11-06 | — | — | EP | disclosed |
| US-6150549-A | Silane compound | NIPPON MITSUBISHI OIL CORPORATION (JP) | 2000-11-21 | — | — | US | disclosed |
| EP-0894802-A2 | Silane compound | NIPPON OIL CO. LTD. (JP) | 1999-02-03 | — | — | EP | disclosed |