Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.44 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | GPR6 | P46095 | 1/20 | 0.39 |
| ▸ | SCD | O00767 | 2/20 | 0.37 |
| ▸ | ABL1 | P00519 | 2/20 | 0.36 |
| ▸ | CYP46A1 | Q9Y6A2 | 3/20 | 0.36 |
| ▸ | MGLL | Q99685 | 2/20 | 0.36 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | SOST | Q9BQB4 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28853727 | 0.85 | SMYD3 (0.43) | SMYD3SIRT3TDP1GPR6SCD | |
| SCHEMBL18228493 | 0.80 | NAMPT (0.46) | SMYD3SIRT3TDP1GPR6MGLL | |
| SCHEMBL28188447 | 0.78 | SLC18A3 (0.54) | TDP1MGLLACKR3CYP3A4GAA | |
| SCHEMBL28188540 | 0.70 | MGLL (0.41) | MGLLPOLBHSD11B1 | |
| SCHEMBL27737579 | 0.68 | HSD11B1 (0.55) | ACKR3HSD11B1 | |
| SCHEMBL28853734 | 0.68 | SLC18A3 (0.57) | MGLLPOLBHSD11B1 | |
| SCHEMBL8020048 | 0.66 | TDP1 (0.61) | SMYD3SIRT3TDP1KDM4EGAA | |
| SCHEMBL23798470 | 0.65 | SIRT3 (0.41) | SMYD3SIRT3TDP1 | |
| SCHEMBL20148710 | 0.64 | SIRT3 (0.43) | SMYD3SIRT3TDP1CYP11B2SOST | |
| SCHEMBL27968954 | 0.64 | KDM2B (0.52) | CYP3A4KDM4EPOLBGAAMAPT |
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-107635986-A | Substituted quinoxaline derivatives | 赛尔维他股份公司 | 2018-01-26 | — | — | CN | disclosed |