Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | DGKA | P23743 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28629828 | 1.00 | NAAA (0.46) | NAAAALDH1A1ATMDGKANPSR1 | |
| SCHEMBL10775576 | 0.93 | NAAA (0.56) | NAAADGKANPSR1L3MBTL1MAPT | |
| SCHEMBL10780813 | 0.93 | NAAA (0.56) | NAAADGKANPSR1L3MBTL1MAPT | |
| SCHEMBL10780879 | 0.93 | NAAA (0.56) | NAAADGKANPSR1L3MBTL1MAPT | |
| SCHEMBL6156482 | 0.89 | ALDH1A1 (0.36) | NAAAALDH1A1DGKANPSR1L3MBTL1 | |
| SCHEMBL6153346 | 0.88 | ALDH1A1 (0.52) | NAAAALDH1A1ATMDGKANPSR1 | |
| SCHEMBL9742722 | 0.85 | NAAA (0.48) | NAAAALDH1A1ATMDGKANPSR1 | |
| SCHEMBL19837599 | 0.83 | GPR84 (0.48) | NAAAALDH1A1ATMDGKANPSR1 | |
| SCHEMBL8862337 | 0.83 | NAAA (0.47) | NAAAALDH1A1ATMDGKANPSR1 | |
| SCHEMBL6154556 | 0.82 | NAAA (0.61) | NAAAALDH1A1DGKANPSR1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109053479-B | Method for synthesizing quaternary amine inner salt | 兆科药业（合肥）有限公司 | 2021-09-07 | — | — | CN | disclosed |
| EP-0970947-B1 | PROCESS FOR PRODUCING BUTYRIC ESTER DERIVATIVES | KANEKA CORP (JP) | 2005-01-26 | — | — | EP | disclosed |
| US-6140527-A | Process for producing butyric ester derivatives | KANEKA CORPORATION (JP) | 2000-10-31 | — | — | US | disclosed |
| EP-0970947-A1 | PROCESS FOR PRODUCING BUTYRIC ESTER DERIVATIVES | KANEKA CORPORATION (JP) | 2000-01-12 | — | — | EP | disclosed |