Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | MPO | P05164 | 1/20 | 0.37 |
| ▸ | HPGDS | O60760 | 1/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.35 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL23501033 | 1.00 | HTR3A (0.42) | HTR3AMPOHPGDSCHEK1CCNA2 | |
| SCHEMBL16992452 | 0.89 | SLC18A3 (0.41) | SLC18A3SIGMAR1 | |
| SCHEMBL26545449 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL21639947 | 0.82 | CHRNA4 (0.39) | — | |
| SCHEMBL110926 | 0.78 | — | — | |
| SCHEMBL17675557 | 0.74 | EIF2AK4 (0.34) | — | |
| SCHEMBL8060559 | 0.72 | L3MBTL1 (0.36) | — | |
| SCHEMBL14255952 | 0.70 | REN (0.36) | — | |
| SCHEMBL14255948 | 0.70 | — | — | |
| SCHEMBL2284072 | 0.68 | HTR3A (0.43) | HTR3AMPOSLC18A3SIGMAR1 |
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-107849039-A | The aminopyridine compounds substituted through heteroaryl | 百时美施贵宝公司 | 2018-03-27 | — | — | CN | claimed |
| WO-2021115444-A1 | MONOCYCLIC β-LACTAM COMPOUND AND USE THEREOF | 苏州信诺维医药科技股份有限公司 | 2021-06-17 | — | — | WO | disclosed |