Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | NQO1 | P15559 | 1/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18929969 | 0.85 | NQO1 (0.50) | KDM4ENQO1AKR1C3AKR1C2TSHR | |
| SCHEMBL28029949 | 0.80 | LMNA (0.38) | KDM4ENQO1TSHRMEN1KMT2A | |
| SCHEMBL10604152 | 0.79 | KDM4E (0.49) | KDM4ENQO1AKR1C3AKR1C2TSHR | |
| SCHEMBL5055098 | 0.76 | ADRA2A (0.62) | KDM4ENQO1AKR1C3AKR1C2TSHR | |
| SCHEMBL7784261 | 0.76 | ADRA2A (0.62) | KDM4ENQO1AKR1C3AKR1C2TSHR | |
| SCHEMBL29657372 | 0.76 | NQO1 (0.59) | KDM4ENQO1TSHRMEN1KMT2A | |
| SCHEMBL2498271 | 0.76 | NQO1 (0.59) | KDM4ENQO1TSHRMEN1KMT2A | |
| SCHEMBL28029625 | 0.76 | KDM4E (0.49) | KDM4ENQO1TSHRMEN1KMT2A | |
| SCHEMBL7152597 | 0.75 | ADRA1A (0.63) | KDM4ENQO1TSHRMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL9868612 | 0.75 | MEN1 (0.63) | KDM4ENQO1AKR1C3AKR1C2HIF1A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104829546-A | Double-triazole substituted ethoxy benzene compound and preparation method and application thereof | UNIV TIANJIN NORMAL | 2015-08-12 | — | — | CN | claimed |
| CN-104829546-A | Double-triazole substituted ethoxy benzene compound and preparation method and application thereof | UNIV TIANJIN NORMAL | 2015-08-12 | — | — | CN | disclosed |