Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 5/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 5/20 | 0.55 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.43 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ERN1 | O75460 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8697211 | 0.98 | ALDH1A1 (0.55) | ADRA1DADRA1AADRA1BALDH1A1KDM4E | |
| SCHEMBL21524884 | 0.86 | ADRA1D (0.52) | ADRA1DADRA1AADRA1BALDH1A1HTT | |
| SCHEMBL11329325 | 0.80 | ALDH1A1 (0.62) | ALDH1A1KDM4ETDP1L3MBTL1MAPT | |
| SCHEMBL8698351 | 0.78 | ADRA1D (0.46) | ADRA1DADRA1AADRA1BALDH1A1KDM4E | |
| SCHEMBL9034623 | 0.78 | LTA4H (0.43) | ADRA1DADRA1AADRA1BHRH3 | |
| SCHEMBL29020313 | 0.73 | ALDH1A1 (0.44) | ADRA1DADRA1AADRA1BALDH1A1KDM4E | |
| SCHEMBL24732865 | 0.73 | ALDH1A1 (0.51) | ALDH1A1KDM4ETDP1L3MBTL1MAPT | |
| SCHEMBL619338 | 0.73 | KDM4E (0.71) | ADRA1DADRA1AADRA1BALDH1A1KDM4E | |
| SCHEMBL12203995 | 0.73 | KDM4E (0.51) | ALDH1A1KDM4ETDP1L3MBTL1MAPT | |
| SCHEMBL24732893 | 0.73 | ALDH1A1 (0.51) | ALDH1A1KDM4ETDP1L3MBTL1MAPT |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117736210-A | Aromatic heterocyclic compound, and preparation method and application thereof | 上海翊石医药科技有限公司 | 2024-03-22 | — | — | CN | disclosed |
| CN-114805341-B | Aromatic heterocyclic compound, and preparation method and application thereof | 上海翊石医药科技有限公司 | 2023-12-08 | — | — | CN | disclosed |
| WO-2022161420-A1 | CLASS OF HETEROAROMATIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF | 上海翊石医药科技有限公司 | 2022-08-04 | — | — | WO | disclosed |
| CN-114805341-A | Aromatic heterocyclic compounds and preparation method and application thereof | 上海翊石医药科技有限公司 | 2022-07-29 | — | — | CN | disclosed |
| US-5834460-A | FOR TREATMENT OF BRAIN OR PSYCHOLOGICAL DISORDERS, ALZHEIMER*S DISEASE, MENTAL RETARDATION OR AUTISM | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1998-11-10 | — | — | US | disclosed |
| EP-0696586-A1 | SERINE DERIVATIVE | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1996-02-14 | — | — | EP | disclosed |