Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | FKBP1A | P62942 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27363236 | 0.93 | CYP3A4 (0.46) | CYP3A4CYP2D6CA12CA1CA2 | |
| SCHEMBL53552 | 0.84 | ACE (0.42) | CYP3A4CYP2D6CNR2 | |
| SCHEMBL2737878 | 0.84 | ACE (0.42) | CYP3A4CYP2D6CNR2 | |
| SCHEMBL2737876 | 0.84 | CYP3A4 (0.40) | CYP3A4CYP2D6CNR2CYP1A2CA12 | |
| SCHEMBL8283032 | 0.84 | CYP3A4 (0.40) | CYP3A4CYP2D6CNR2CYP1A2CA12 | |
| SCHEMBL761869 | 0.84 | CYP3A4 (0.40) | CYP3A4CYP2D6CNR2CYP1A2CA12 | |
| SCHEMBL58093 | 0.84 | ACE (0.42) | CYP3A4CYP2D6CNR2 | |
| SCHEMBL2616299 | 0.83 | FKBP1A (0.49) | CYP3A4CYP2D6FKBP1A | |
| SCHEMBL12886363 | 0.83 | FKBP1A (0.49) | CYP3A4CYP2D6FKBP1A | |
| SCHEMBL15316989 | 0.83 | FKBP1A (0.49) | CYP3A4CYP2D6FKBP1A |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108138069-A | Lubricant oil composite containing amidine antioxidant | 雪佛龙奥伦耐有限责任公司 | 2018-06-08 | — | — | CN | claimed |
| CN-107735471-A | Serosity combination and additive and method for polishing organic polymer-based ophthalmically acceptable base material | 费罗公司 | 2018-02-23 | — | — | CN | claimed |
| CN-108430613-A | Zwitterionic sulfone polymer blend and hollow fiber membranes | 通用电气公司 | 2018-08-21 | — | — | CN | disclosed |
| CN-107735471-A | Serosity combination and additive and method for polishing organic polymer-based ophthalmically acceptable base material | 费罗公司 | 2018-02-23 | — | — | CN | disclosed |
| CN-107106993-A | Amphion functionalized copolymers hollow-fibre membrane and correlation technique | 通用电气公司 | 2017-08-29 | — | — | CN | disclosed |
| CN-106999869-A | The block copolymer film of amphion functionalization and related block copolymer composition | 通用电气公司 | 2017-08-01 | — | — | CN | disclosed |