Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 4/20 | 0.47 |
| ▸ | AHR | P35869 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 11/20 | 0.44 |
| ▸ | CA2 | P00918 | 11/20 | 0.44 |
| ▸ | CA4 | P22748 | 11/20 | 0.44 |
| ▸ | CA6 | P23280 | 11/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 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 | |
|---|---|---|---|---|
| SCHEMBL19916051 | 0.81 | KIF11 (0.49) | KIF11AHRCA1CA2CA4 | |
| SCHEMBL30631720 | 0.78 | KIF11 (0.56) | KIF11AHRCA1CA2CA4 | |
| SCHEMBL11992353 | 0.78 | KIF11 (0.56) | KIF11AHRCA1CA2CA4 | |
| Carbazole SCHEMBL29015265 | 0.78 | CA1 (0.47) | CA1CA2CA4CA6KDM4E | |
| SCHEMBL17206856 | 0.76 | KIF11 (0.53) | KIF11AHRCA1CA2CA4 | |
| SCHEMBL20165853 | 0.74 | CA1 (0.59) | CA1CA2CA4CA6 | |
| SCHEMBL30116551 | 0.72 | KIF11 (0.56) | KIF11AHRCA1CA2CA4 | |
| SCHEMBL11992354 | 0.72 | KIF11 (0.56) | KIF11AHRCA1CA2CA4 | |
| SCHEMBL21692091 | 0.71 | KIF11 (0.60) | KIF11AHRCA1CA2CA4 | |
| SCHEMBL25612670 | 0.71 | CYP1A2 (0.39) | KDM4EMAPTPGR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010136109-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2010-12-02 | — | — | WO | disclosed |