Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 7/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | ATP2A2 | P16615 | 1/20 | 0.54 |
| ▸ | ATP2A3 | Q93084 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 4/20 | 0.43 |
| ▸ | TYR | P14679 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | MIF | P14174 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2244012 | 0.86 | ALOX15 (0.54) | ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT | |
| SCHEMBL23409677 | 0.86 | ALOX15 (0.54) | ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT | |
| SCHEMBL30449795 | 0.84 | SMN1; SMN2 (0.52) | ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT | |
| SCHEMBL11443426 | 0.84 | SMN1; SMN2 (0.52) | ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT | |
| SCHEMBL28407896 | 0.82 | ALOX15 (0.54) | ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT | |
| SCHEMBL28404267 | 0.82 | ALOX15 (0.54) | ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT | |
| SCHEMBL9820540 | 0.81 | ALDH1A1 (0.59) | ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT | |
| SCHEMBL27851718 | 0.80 | SMN1; SMN2 (0.52) | ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT | |
| SCHEMBL8657395 | 0.79 | ALDH1A1 (0.41) | ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT | |
| SCHEMBL785003 | 0.78 | ALOX15 (0.47) | ALOX15ALDH1A1SMN1; SMN2CYP1A2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-113292400-A | Method for dealkylating alkyl cresol and application of acidic ionic liquid catalyst | 天津天大天海化工新技术有限公司 | 2021-08-24 | — | — | CN | disclosed |