Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPB1 | P15086 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | TNKS | O95271 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.32 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL9724918 | 1.00 | CPB1 (0.38) | CPB1CYP3A4CYP2C19ALDH1A1CYP1A2 | |
| SCHEMBL9724926 | 1.00 | CPB1 (0.38) | CPB1CYP3A4CYP2C19ALDH1A1CYP1A2 | |
| SCHEMBL9724818 | 0.78 | CYP2A6 (0.41) | CPB1CYP3A4ALDH1A1MAPTCYP2A6 | |
| SCHEMBL9724816 | 0.78 | CYP2A6 (0.41) | CPB1CYP3A4ALDH1A1MAPTCYP2A6 | |
| SCHEMBL9724812 | 0.78 | CYP2A6 (0.41) | CPB1CYP3A4ALDH1A1MAPTCYP2A6 | |
| SCHEMBL9724997 | 0.71 | GAA (0.44) | CPB1CYP3A4CYP2C19ALDH1A1CYP1A2 | |
| SCHEMBL9724999 | 0.71 | GAA (0.44) | CPB1CYP3A4CYP2C19ALDH1A1CYP1A2 | |
| SCHEMBL9724994 | 0.71 | GAA (0.44) | CPB1CYP3A4CYP2C19ALDH1A1CYP1A2 | |
| SCHEMBL28994467 | 0.70 | CYP3A4 (0.44) | CPB1CYP3A4ALDH1A1MAPTKDM4E | |
| SCHEMBL28994070 | 0.70 | ALDH1A1 (0.47) | CYP3A4CYP2C19ALDH1A1MAPTKDM4E |
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-5162357-A | FUNGICIDAL AZOLYLMETHYLOXIRANES | BASF AKTIENGESELLSCHAFT (DE) | 1992-11-10 | — | — | US | disclosed |