Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.49 |
| ▸ | DRD1 | P21728 | 1/20 | 0.49 |
| ▸ | KCNQ2 | O43526 | 7/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.43 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.43 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.43 |
| ▸ | KCNQ4 | P56696 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL7896659 | 0.98 | DRD2 (0.48) | DRD2DRD1KCNQ2KEAP1CYP2C9 | |
| SCHEMBL7898832 | 0.85 | MEN1 (0.47) | DRD1KCNQ2KEAP1CYP1A2CYP3A4 | |
| SCHEMBL9175899 | 0.83 | KCNA3 (0.45) | DRD2DRD1KCNQ2CYP2C9MEN1 | |
| SCHEMBL10632671 | 0.82 | KCNQ2 (0.50) | KCNQ2KEAP1CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL7896013 | 0.80 | HPGD (0.41) | DRD2DRD1KCNQ2MEN1MAPT | |
| SCHEMBL7888666 | 0.79 | KEAP1 (0.47) | KCNQ2KEAP1CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL5795215 | 0.77 | KEAP1 (0.50) | KCNQ2KEAP1CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL7888633 | 0.77 | KEAP1 (0.50) | KCNQ2KEAP1CYP2C9CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL17872002 | 0.77 | KEAP1 (0.46) | KCNQ2KEAP1CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL5487545 | 0.77 | CHRNA7 (0.44) | DRD1KCNQ2KEAP1CYP2C9CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| JP-8053413-A | — | — | None | — | — | JP | disclosed |
| CN-107880046-B | A kind of preparation method of dibenzo [b, e] azepines compound | 青岛农业大学 | 2019-11-15 | — | — | CN | disclosed |
| CN-107880046-A | A kind of preparation method of dibenzo [b, e] azepines compound | 青岛农业大学 | 2018-04-06 | — | — | CN | disclosed |
| JP-H0853413-A | GAMMA-BUTYROLACTAMS | BAYER AG | 1996-02-27 | — | — | JP | disclosed |