Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | MLNR | O43193 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | FFAR4 | Q5NUL3 | 3/20 | 0.37 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 5/20 | 0.36 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.33 |
| ▸ | CHKA | P35790 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16257976 | 0.77 | CYP17A1 (0.49) | CYP17A1CYP11B1CYP11B2PDE3BPDE3A | |
| SCHEMBL16258035 | 0.77 | CYP17A1 (0.49) | CYP17A1CYP11B1CYP11B2PDE3BPDE3A | |
| SCHEMBL16258016 | 0.77 | CYP17A1 (0.49) | CYP17A1CYP11B1CYP11B2PDE3BPDE3A | |
| SCHEMBL17827802 | 0.75 | CTSC (0.34) | MLNRCYP2D6FFAR4HRH3CHKA | |
| SCHEMBL16258018 | 0.74 | CYP17A1 (0.46) | CYP17A1CYP11B1CYP11B2PDE3BPDE3A | |
| SCHEMBL30695094 | 0.74 | CYP17A1 (0.46) | CYP17A1CYP11B1CYP11B2PDE3BPDE3A | |
| SCHEMBL16258129 | 0.74 | CYP17A1 (0.46) | CYP17A1CYP11B1CYP11B2PDE3BPDE3A | |
| SCHEMBL16258128 | 0.74 | CYP17A1 (0.46) | CYP17A1CYP11B1CYP11B2PDE3BPDE3A | |
| SCHEMBL16748099 | 0.73 | CYP17A1 (0.57) | CYP17A1CYP11B1CYP11B2MLNRCYP2D6 | |
| SCHEMBL16258030 | 0.72 | RARB (0.52) | CYP17A1CYP11B1CYP11B2HTR2AAKR1C2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9404038-B2 | Cyclopropyl-bearing liquid crystal compounds and mixtures | SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD. (CN) | 2016-08-02 | — | — | US | disclosed |
| US-9404038-B2 | Cyclopropyl-bearing liquid crystal compounds and mixtures | SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD. (CN) | 2016-08-02 | — | — | US | disclosed |
| US-20160168461-A1 | CYCLOPROPYL-BEARING LIQUID CRYSTAL COMPOUNDS AND MIXTURES | SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD. (CN) | 2016-06-16 | — | — | US | disclosed |
| US-20160168461-A1 | CYCLOPROPYL-BEARING LIQUID CRYSTAL COMPOUNDS AND MIXTURES | SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD. (CN) | 2016-06-16 | — | — | US | disclosed |