Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | AR | P10275 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | ACACB | O00763 | 1/20 | 0.31 |
| ▸ | ACACA | Q13085 | 1/20 | 0.31 |
| ▸ | AXL | P30530 | 1/20 | 0.31 |
| ▸ | NOX4 | Q9NPH5 | 1/20 | 0.31 |
| ▸ | KIF11 | P52732 | 1/20 | 0.31 |
| ▸ | BRPF1 | P55201 | 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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL28043656 | 0.80 | DAO (0.42) | ALOX5TDP1PARP1CA12CA9 | |
| SCHEMBL28338789 | 0.69 | IMPDH2 (0.38) | ARTDP1PARP1KDM4EKIF11 | |
| SCHEMBL18149140 | 0.68 | ALOX5 (0.58) | ALOX5KDM4ETP53CA12CA9 | |
| SCHEMBL18327471 | 0.68 | ALOX5 (0.58) | ALOX5KDM4ETP53NOX4KIF11 | |
| Tert-Butyl Formate SCHEMBL28094505 | 0.67 | MAPT (0.66) | TDP1KDM4E | |
| Tert-Butyl Formate SCHEMBL28826667 | 0.67 | TDP1 (0.37) | ARTDP1PARP1KDM4E | |
| SCHEMBL18149341 | 0.66 | ALOX5 (0.56) | ALOX5PARP1KDM4ETP53CA12 | |
| Tert-Butyl Formate SCHEMBL28000739 | 0.66 | CYP2A6 (0.46) | TDP1CA12CA9 | |
| SCHEMBL18164723 | 0.63 | ALOX5 (0.51) | ALOX5PARP1KDM4ETP53NOX4 | |
| SCHEMBL4402967 | 0.63 | ALOX5 (0.51) | ALOX5KDM4ETP53ACACBACACA |
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 |
|---|---|---|---|---|---|---|---|
| CN-105164122-A | Substituted oxopyridine derivatives and their use in the treatment of cardiovascular disorders | Bayer Pharma AG | 2015-12-16 | — | — | CN | disclosed |