Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESRRA | P11474 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | HTR1B | P28222 | 3/20 | 0.40 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.39 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.39 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.39 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL29549546 | 0.84 | ALDH1A1 (0.48) | ALDH1A1 | |
| SCHEMBL10359650 | 0.83 | ALDH1A1 (0.44) | ESRRAALDH1A1HTR1BSIRT2SIRT1 | |
| SCHEMBL28369871 | 0.83 | NCEH1 (0.43) | ALDH1A1HPGDHSD17B10CYP1A2 | |
| SCHEMBL28373877 | 0.83 | ITGB2 (0.47) | ALDH1A1CYP2A6CTDSP1HPGDHSD17B10 | |
| SCHEMBL5552568 | 0.83 | SMN1; SMN2 (0.47) | ALDH1A1HPGDCYP1A2 | |
| SCHEMBL10961583 | 0.82 | IDO1 (0.53) | ALDH1A1IDO1GAAMAPK1 | |
| SCHEMBL4365850 | 0.81 | ALDH1A1 (0.58) | ESRRAALDH1A1CYP2A6HTR1BHPGD | |
| SCHEMBL8936775 | 0.81 | SLC6A2 (0.55) | ESRRAALDH1A1CYP2A6HPGDCYP1A2 | |
| SCHEMBL7220532 | 0.81 | ESRRA (0.46) | ESRRAALDH1A1CYP2A6SIRT2SIRT1 | |
| SCHEMBL81416 | 0.81 | ALDH1A1 (0.46) | ESRRAALDH1A1CYP2A6HTR1BSIRT2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109651208-A | N- arylsulfonamides compound, medical composition and its use | 中国科学院上海药物研究所 | 2019-04-19 | — | — | CN | disclosed |
| US-4426385-A | Insecticidal bicyclooxyphenyl ureas | UNION CARBIDE CORPORATION (US) | 1984-01-17 | — | — | US | disclosed |
| EP-0050321-A2 | Novel bicyclooxyphenyl ureas, process for their preparation and pesticides containing them | UNION CARBIDE CORPORATION (US) | 1982-04-28 | — | — | EP | disclosed |