Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | FAAH | O00519 | 1/20 | 0.42 |
| ▸ | MGLL | Q99685 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.40 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4549801 | 0.79 | PLA2G1B (0.48) | IDO1KDM4EALDH1A1LMNAKMT2A | |
| SCHEMBL11176007 | 0.78 | GAA (0.53) | IDO1KDM4EMAPTALDH1A1LMNA | |
| SCHEMBL1999167 | 0.76 | IDO1 (0.52) | IDO1MAPTALDH1A1L3MBTL1FAAH | |
| SCHEMBL965837 | 0.75 | LMNA (0.59) | KDM4EMAPTALDH1A1LMNAL3MBTL1 | |
| SCHEMBL9529403 | 0.73 | MEN1 (0.50) | MAPTALDH1A1LMNAL3MBTL1CNR2 | |
| SCHEMBL10610797 | 0.73 | ALDH1A1 (0.47) | IDO1MAPTALDH1A1LMNAL3MBTL1 | |
| SCHEMBL4592244 | 0.73 | CTBP2 (0.48) | IDO1MAPTALDH1A1LMNAL3MBTL1 | |
| 1,4-Dichlorobenzene SCHEMBL27669699 | 0.72 | MAPT (0.58) | IDO1KDM4EMAPTALDH1A1LMNA | |
| SCHEMBL17794373 | 0.72 | GAA (0.67) | MAPTALDH1A1LMNACYP2C9CYP2C19 | |
| SCHEMBL10982736 | 0.71 | EGFR (0.69) | MAPTALDH1A1MEN1KMT2AEGFR |
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 |
|---|---|---|---|---|---|---|---|
| CN-106632129-B | The double thioether analog derivative, preparation method and application of (thiophene) diazole are disliked containing 1,3,4- | 贵州大学 | 2019-06-07 | — | — | CN | disclosed |
| CN-106167472-B | A kind of 2,5- substituent groups -1,3,4- oxadiazole double thioethers analog derivative, preparation method and application | 贵州大学 | 2018-07-27 | — | — | CN | disclosed |
| CN-106632129-A | Disulfide derivative containing 1,3,4-oxa(thia)diazole and preparation method and application of derivative | 贵州大学 | 2017-05-10 | — | — | CN | disclosed |
| CN-106167472-A | A kind of 2,5 substituent group 1,3,4 diazole thioether analog derivatives, its preparation method and application | 贵州大学 | 2016-11-30 | — | — | CN | disclosed |