Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 7/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 5/20 | 0.37 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.37 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | HEXA | P06865 | 1/20 | 0.34 |
| ▸ | HEXB | P07686 | 1/20 | 0.34 |
| ▸ | CTSD | P07339 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | LCK | P06239 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4580149 | 0.83 | DNMT1 (0.53) | CYP1A2ALDH1A1HSD17B10HPGDHIF1A | |
| SCHEMBL9131092 | 0.83 | DNMT1 (0.47) | CYP1A2ALDH1A1HSD17B10HPGDCES1 | |
| SCHEMBL7055520 | 0.81 | ALDH1A1 (0.50) | CYP1A2ALDH1A1HSD17B10HPGDCES1 | |
| SCHEMBL28247760 | 0.81 | CYP1A2 (0.47) | CYP1A2ALDH1A1HSD17B10HPGDCES1 | |
| SCHEMBL3869266 | 0.79 | CES1 (0.44) | CYP1A2ALDH1A1HSD17B10HPGDCES1 | |
| SCHEMBL29410607 | 0.79 | CES1 (0.44) | CYP1A2ALDH1A1HSD17B10HPGDCES1 | |
| SCHEMBL8865515 | 0.79 | CYP1A2 (0.52) | CYP1A2ALDH1A1HSD17B10HPGDCES1 | |
| SCHEMBL29177671 | 0.79 | HPRT1 (0.50) | CYP1A2ALDH1A1HSD17B10HPGDHIF1A | |
| SCHEMBL29810631 | 0.78 | CES1 (0.43) | CYP1A2ALDH1A1HSD17B10HPGDCES1 | |
| SCHEMBL27987274 | 0.77 | MEN1 (0.35) | CYP1A2ALDH1A1HSD17B10HPGDCYP1B1 |
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-2003062350-A1 | LIQUID SCINTILLATION COUNTING | PACKARD BIOSCIENCE B.V. (NL) | 2003-07-31 | — | — | WO | disclosed |