Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.47 |
| ▸ | KIF11 | P52732 | 4/20 | 0.40 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | DAO | P14920 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | DRD4 | P21917 | 2/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | NAAA | Q02083 | 1/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL26933602 | 1.00 | KDM1A (0.47) | KDM1AKIF11IDO1DAOCYP11B1 | |
| SCHEMBL26933596 | 1.00 | KDM1A (0.47) | KDM1AKIF11IDO1DAOCYP11B1 | |
| Hydrochloric Acid SCHEMBL30636281 | 0.99 | KDM1A (0.46) | KDM1AKIF11IDO1DAOCYP11B1 | |
| SCHEMBL26933298 | 0.83 | GRM2 (0.44) | SLC6A4DRD4SLC6A2SLC6A3KCNH2 | |
| SCHEMBL26933291 | 0.83 | GRM2 (0.44) | SLC6A4DRD4SLC6A2SLC6A3KCNH2 | |
| Hydrochloric Acid SCHEMBL30636343 | 0.82 | GRM2 (0.43) | SLC6A4DRD4SLC6A2SLC6A3KCNH2 | |
| Hydrochloric Acid SCHEMBL21491497 | 0.82 | GRM2 (0.43) | SLC6A4DRD4SLC6A2SLC6A3KCNH2 | |
| Hydrochloric Acid SCHEMBL21491496 | 0.82 | GRM2 (0.43) | SLC6A4DRD4SLC6A2SLC6A3KCNH2 | |
| SCHEMBL3122265 | 0.79 | KIF11 (0.39) | KDM1AKIF11DAOSLC6A4DRD4 | |
| SCHEMBL26933269 | 0.78 | EPHX2 (0.42) | KIF11FFAR1DRD4MGLLGRM2 |
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-117062804-A | 1, 3-substituted cyclobutyl derivatives and their use | 诺华股份有限公司 | 2023-11-14 | — | — | CN | disclosed |