Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 3/20 | 0.34 |
| ▸ | RARB | P10826 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13818299 | 0.92 | TSHR (0.45) | CES2CYP2C19POLBBLMATM | |
| SCHEMBL12231851 | 0.92 | CYP2C19 (0.43) | CES2CYP2C19POLBBLMATM | |
| SCHEMBL4473680 | 0.92 | CYP2C19 (0.43) | CES2CYP2C19POLBBLMATM | |
| SCHEMBL12231848 | 0.88 | ALDH1A1 (0.47) | CES2CYP2C19POLBBLMATM | |
| SCHEMBL26430818 | 0.88 | CYP2C19 (0.40) | CES2CYP2C19POLBBLMATM | |
| SCHEMBL15890591 | 0.85 | CYP2C19 (0.41) | CES2CYP2C19POLBBLMATM | |
| SCHEMBL13079898 | 0.83 | ALDH1A1 (0.45) | CES2CYP2C19POLBBLMATM | |
| SCHEMBL6833578 | 0.83 | CES2 (0.39) | CES2MEN1THRBHTTKMT2A | |
| SCHEMBL16259206 | 0.81 | CYP2C19 (0.41) | CES2CYP2C19POLBBLMATM | |
| SCHEMBL30917919 | 0.81 | CES2 (0.42) | CES2CYP2C19POLBBLMATM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004099173-A1 | MULTIVALENT INHIBITORS OF SERUM AMYLOID P COMPONENT | THERACARB INC. (CA) | 2004-11-18 | — | — | WO | disclosed |