Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 4/20 | 0.45 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.45 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.45 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.44 |
| ▸ | NAMPT | P43490 | 1/20 | 0.43 |
| ▸ | CDC7 | O00311 | 2/20 | 0.40 |
| ▸ | DBF4 | Q9UBU7 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KDM5A | P29375 | 1/20 | 0.39 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28934718 | 1.00 | GABRA1 (0.45) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL18316510 | 0.88 | GABRB2 (0.55) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL20971369 | 0.88 | GABRB2 (0.55) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL29215821 | 0.88 | GABRB2 (0.55) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL28934655 | 0.83 | KDM5A (0.50) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL28934658 | 0.83 | KDM5A (0.50) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL28934789 | 0.81 | KDM5A (0.50) | CYP1A2CYP3A4LMNAKDM4EALDH1A1 | |
| SCHEMBL28934791 | 0.81 | KDM5A (0.50) | CYP1A2CYP3A4LMNAKDM4EALDH1A1 | |
| SCHEMBL12458255 | 0.81 | NOTUM (0.49) | GABRA1GABRB2CYP1A2LMNAGABRA2 | |
| SCHEMBL28934812 | 0.80 | GAA (0.47) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115461338-B | 3-azabicyclo (3.1.0) hexane derivatives having KDM5 inhibitory activity and uses thereof | 小野药品工业株式会社 | 2024-02-20 | — | — | CN | disclosed |
| CN-115461338-A | 3-azabicyclo (3.1.0) hexane derivatives having KDM5 inhibitory activity and uses thereof | 小野药品工业株式会社 | 2022-12-09 | — | — | CN | disclosed |