Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 3/20 | 0.37 |
| ▸ | CES1 | P23141 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | NOS3 | P29474 | 2/20 | 0.32 |
| ▸ | NOS1 | P29475 | 2/20 | 0.32 |
| ▸ | NOS2 | P35228 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7197550 | 0.87 | TP53 (0.38) | CES2CES1ALDH1A1LMNAMEN1 | |
| Bromide SCHEMBL28036599 | 0.85 | TP53 (0.36) | CES2CES1ALDH1A1MEN1KMT2A | |
| SCHEMBL7193909 | 0.79 | LTA4H (0.38) | CES2CES1LMNASMN1; SMN2CYP3A4 | |
| Hydrochloric Acid SCHEMBL29128044 | 0.77 | LTA4H (0.36) | CES2CES1ALDH1A1LMNANOS3 | |
| Phosphonic Acid SCHEMBL27808805 | 0.75 | TAAR1 (0.34) | MEN1KMT2ANOS3NOS1NOS2 | |
| SCHEMBL27712844 | 0.75 | DNM1 (0.40) | CES2CES1ALDH1A1LMNAMEN1 | |
| SCHEMBL27693287 | 0.75 | DNM1 (0.40) | CES2CES1ALDH1A1LMNAMEN1 | |
| Phosphonic Acid SCHEMBL28946016 | 0.72 | CES2 (0.31) | CES2CES1ALDH1A1NAPRT | |
| Phosphonic Acid SCHEMBL28946036 | 0.71 | CES1 (0.33) | CES2CES1ALDH1A1LMNAMEN1 | |
| SCHEMBL27461464 | 0.71 | NOS3 (0.35) | LMNAMEN1KMT2ANOS3NOS1 |
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-107075097-A | Catalyst composition for polyester production process | 科莱恩塑料和涂料有限公司 | 2017-08-18 | — | — | CN | disclosed |