Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 4/20 | 0.36 |
| ▸ | CNR2 | P34972 | 4/20 | 0.36 |
| ▸ | CES2 | O00748 | 4/20 | 0.35 |
| ▸ | CES1 | P23141 | 4/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.30 |
| ▸ | CYP1B1 | Q16678 | 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 | |
|---|---|---|---|---|
| SCHEMBL6527030 | 0.92 | CNR1 (0.37) | CNR1CNR2CES2CES1USP2 | |
| SCHEMBL6474442 | 0.83 | CES2 (0.38) | CES2CES1USP2ALDH1A1LMNA | |
| SCHEMBL6472434 | 0.80 | CES2 (0.41) | CES2CES1USP2ALDH1A1LMNA | |
| SCHEMBL6472601 | 0.79 | CES2 (0.42) | CES2CES1USP2ALDH1A1LMNA | |
| SCHEMBL6472064 | 0.79 | CES2 (0.42) | CES2CES1USP2ALDH1A1LMNA | |
| SCHEMBL6472071 | 0.74 | ALDH1A1 (0.40) | CES2CES1USP2ALDH1A1LMNA | |
| SCHEMBL6471828 | 0.71 | CES2 (0.44) | CES2CES1USP2ALDH1A1LMNA | |
| SCHEMBL5232675 | 0.69 | NR4A1 (0.52) | CNR1CNR2ALDH1A1KDM4E | |
| SCHEMBL6472144 | 0.68 | CES2 (0.46) | CES2CES1USP2ALDH1A1LMNA | |
| SCHEMBL6472045 | 0.67 | CES1 (0.59) | CES2CES1MAPK1KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005109041-A1 | COMPOSITIONS FOR USE IN THE MANUFACTURE OF LENSES | MEDICAL POLYMERS LIMITED (GB) | 2005-11-17 | — | — | WO | claimed |
| WO-2005109041-A1 | COMPOSITIONS FOR USE IN THE MANUFACTURE OF LENSES | MEDICAL POLYMERS LIMITED (GB) | 2005-11-17 | — | — | WO | disclosed |