Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | PTGES | O14684 | 3/20 | 0.49 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.49 |
| ▸ | PPARG | P37231 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | CNR2 | P34972 | 2/20 | 0.44 |
| ▸ | CES2 | O00748 | 2/20 | 0.44 |
| ▸ | CES1 | P23141 | 2/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8089512 | 0.80 | CES1 (0.48) | PPARGMEN1KMT2ACES2CES1 | |
| SCHEMBL88045 | 0.80 | CES1 (0.48) | PPARGMEN1KMT2ACES2CES1 | |
| SCHEMBL23934178 | 0.79 | CES2 (0.50) | PTGESALOX5PPARGMEN1KMT2A | |
| SCHEMBL23934183 | 0.79 | CES2 (0.50) | PTGESALOX5PPARGMEN1KMT2A | |
| SCHEMBL2191998 | 0.79 | CYP3A4 (0.53) | CYP3A4CYP2C9PTGESALOX5PPARG | |
| Styrene SCHEMBL7110641 | 0.77 | ALOX5 (0.43) | CYP3A4CYP2C9PTGESALOX5PPARG | |
| SCHEMBL3979241 | 0.77 | CES1 (0.44) | PPARGMEN1KMT2ACES2CES1 | |
| SCHEMBL12095977 | 0.77 | AKR1B1 (0.52) | CYP2C9PPARGMEN1KMT2ACES2 | |
| SCHEMBL375312 | 0.76 | GRIK1 (0.55) | PTGESALOX5PPARGMEN1KMT2A | |
| SCHEMBL23934240 | 0.76 | GRIK1 (0.55) | PTGESALOX5PPARGMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5483003-A | Thermoplastically processible elastomers with improved optical properties | ROEHM GMBH CHEMISCHE FABRIK (DE) | 1996-01-09 | — | — | US | disclosed |