Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | NOS1 | P29475 | 2/20 | 0.31 |
| ▸ | NOS2 | P35228 | 2/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6679219 | 0.89 | CA1 (0.36) | CYP1A2CA1CA2CA4 | |
| SCHEMBL29449316 | 0.83 | CYP1A2 (0.42) | CYP1A2TDP1NOS1NOS2 | |
| SCHEMBL6537151 | 0.82 | CA1 (0.33) | TDP1CA1CA2CA4 | |
| SCHEMBL31438628 | 0.81 | CYP1A2 (0.37) | CYP1A2TDP1 | |
| SCHEMBL2949968 | 0.80 | SLC6A4 (0.30) | — | |
| Water SCHEMBL31469411 | 0.80 | CYP1A2 (0.39) | CYP1A2TDP1NOS1NOS2 | |
| SCHEMBL855821 | 0.77 | CYP1A2 (0.43) | CYP1A2TDP1NOS1NOS2CA1 | |
| SCHEMBL29449300 | 0.76 | EPHX1 (0.36) | CYP1A2TDP1 | |
| SCHEMBL29449324 | 0.76 | EPHX1 (0.36) | CYP1A2TDP1 | |
| SCHEMBL29449303 | 0.76 | EPHX1 (0.36) | CYP1A2TDP1 |
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-0893459-B1 | Polyester and polyurethane derived from specific alicyclic diols | SHOWA DENKO KK (JP) | 2004-10-20 | — | — | EP | disclosed |
| US-6069222-A | IMPROVED HEAT RESISTANCE, WATER RESISTANCE, WEATHERABILITY AND TRANSPARENCY | SHOWA DENKO K.K. (JP) | 2000-05-30 | — | — | US | disclosed |
| EP-0893459-A1 | Polyester and polyurethane derived from specific alicyclic diols | SHOWA DENKO KABUSHIKI KAISHA (JP) | 1999-01-27 | — | — | EP | disclosed |