Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.32 |
| ▸ | CDK1 | P06493 | 1/20 | 0.32 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.32 |
| ▸ | MDH2 | P40926 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | DHPS | P49366 | 1/20 | 0.30 |
| ▸ | LCK | P06239 | 1/20 | 0.30 |
| ▸ | FYN | P06241 | 1/20 | 0.30 |
| ▸ | DAO | P14920 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9836325 | 0.80 | CES2 (0.39) | CES2CES1PKML3MBTL1ALDH1A1 | |
| SCHEMBL9836321 | 0.77 | CES2 (0.36) | CES2CES1PKML3MBTL1ALDH1A1 | |
| SCHEMBL9834169 | 0.71 | SMYD3 (0.49) | CES2CES1PKML3MBTL1 | |
| SCHEMBL9837319 | 0.69 | SMYD3 (0.49) | — | |
| SCHEMBL9836107 | 0.65 | CYP1A2 (0.45) | L3MBTL1ALDH1A1LMNAMAPK1CCNB2 | |
| SCHEMBL2166098 | 0.63 | CES2 (0.71) | CES2CES1PKML3MBTL1ALDH1A1 | |
| SCHEMBL27675349 | 0.60 | CES2 (0.35) | CES2CES1CNR2LCKFYN | |
| SCHEMBL9835463 | 0.60 | RIPK1 (0.43) | L3MBTL1ALDH1A1CCNB2CDK1CCNB1 | |
| SCHEMBL28459022 | 0.59 | LMNA (0.48) | L3MBTL1ALDH1A1LMNAMAPK1CCNB2 | |
| SCHEMBL9835168 | 0.59 | HPGDS (0.44) | ALDH1A1CNR2 |
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-86105309-A | Oxindole-3-carbonyl amines the compound that replaces as the 1-of anti-inflammatory and anodyne | — | 1987-01-14 | — | — | CN | disclosed |