Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA4 | P22748 | 1/20 | 0.45 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 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 | |
|---|---|---|---|---|
| SCHEMBL7590924 | 0.93 | CA1 (0.50) | CA1CA2CA4NOS1NOS2 | |
| SCHEMBL7598291 | 0.91 | CA1 (0.38) | CA1CA2CA4NOS1NOS2 | |
| SCHEMBL7595347 | 0.88 | CA1 (0.32) | CA1CA2CA4 | |
| SCHEMBL7592388 | 0.87 | CYP1A2 (0.40) | CA1CA2CA4NOS1NOS2 | |
| SCHEMBL7596763 | 0.83 | CA1 (0.42) | CA1CA2CA4NOS1NOS2 | |
| SCHEMBL18567050 | 0.80 | CA1 (0.52) | CA1CA2CA4NOS1NOS2 | |
| SCHEMBL7598282 | 0.80 | CA1 (0.43) | CA1CA2CA4NOS1NOS2 | |
| SCHEMBL7594467 | 0.79 | CYP1A2 (0.44) | CA1CA2CA4NOS1NOS2 | |
| SCHEMBL7595337 | 0.77 | CYP1A2 (0.38) | — | |
| SCHEMBL7599306 | 0.77 | — | — |
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 |