Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 3/20 | 0.68 |
| ▸ | TP53 | P04637 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | CES2 | O00748 | 1/20 | 0.54 |
| ▸ | CES1 | P23141 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.50 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.46 |
| ▸ | FEN1 | P39748 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11674348 | 0.86 | POLB (0.66) | POLBTP53ALDH1A1CES2CES1 | |
| SCHEMBL9001692 | 0.85 | NPSR1 (0.61) | POLBTP53ALDH1A1NPSR1HTT | |
| SCHEMBL3455835 | 0.81 | POLB (1.00) | POLBTP53ALDH1A1CES2CES1 | |
| SCHEMBL4617816 | 0.80 | POLB (0.50) | POLBTP53ALDH1A1CES2CES1 | |
| SCHEMBL11375658 | 0.80 | POLB (0.58) | POLBTP53ALDH1A1CES2CES1 | |
| SCHEMBL10868476 | 0.79 | ALDH1A1 (0.61) | POLBALDH1A1NPSR1HTTNPC1 | |
| SCHEMBL11374524 | 0.78 | POLB (0.56) | POLBTP53ALDH1A1CES2CES1 | |
| SCHEMBL28081508 | 0.78 | HPGD (0.56) | POLBTP53ALDH1A1NPSR1HTT | |
| SCHEMBL3810472 | 0.77 | POLB (0.47) | POLBTP53ALDH1A1CES2CES1 | |
| SCHEMBL2447441 | 0.77 | POLB (0.63) | POLBTP53ALDH1A1CES2CES1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1044948-A2 | Removal of an impurity from a mixture with a co-distillant | OCCIDENTAL CHEMICAL CORPORATION (US) | 2000-10-18 | — | — | EP | claimed |
| US-5977397-A | Removal of an impurity from a mixture with a codistillant | OCCIDENTAL CHEMICAL CORPORATION | 1999-11-02 | — | — | US | claimed |
| EP-1044948-A2 | Removal of an impurity from a mixture with a co-distillant | OCCIDENTAL CHEMICAL CORPORATION (US) | 2000-10-18 | — | — | EP | disclosed |
| US-5977397-A | Removal of an impurity from a mixture with a codistillant | OCCIDENTAL CHEMICAL CORPORATION | 1999-11-02 | — | — | US | disclosed |