Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 3/20 | 0.35 |
| ▸ | LDHB | P07195 | 3/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27814561 | 0.94 | BCHE (0.33) | LDHALDHBBCHEACHEMAOB | |
| SCHEMBL27807281 | 0.88 | ALDH1A1 (0.47) | BCHEACHEKDM4EHSD17B10ALDH1A1 | |
| SCHEMBL27736680 | 0.87 | HDAC3 (0.35) | LDHALDHBACHEKDM4EHSD17B10 | |
| SCHEMBL5427708 | 0.76 | ALDH1A1 (0.44) | BCHEACHEKDM4EHSD17B10ALDH1A1 | |
| SCHEMBL28037612 | 0.75 | ALDH1A1 (0.37) | LDHALDHBKDM4EHSD17B10ALDH1A1 | |
| SCHEMBL27304277 | 0.72 | ALDH1A1 (0.53) | BCHEACHEMAOBKDM4EHSD17B10 | |
| SCHEMBL10836717 | 0.70 | ALDH1A1 (0.42) | KDM4EALDH1A1MAPK1CYP3A4MAPT | |
| SCHEMBL28868292 | 0.70 | MCL1 (0.41) | KDM4EHSD17B10ALDH1A1MAPK1TDP1 | |
| SCHEMBL27661280 | 0.69 | ALDH1A1 (0.61) | BCHEACHEMAOBKDM4EHSD17B10 | |
| SCHEMBL28084657 | 0.69 | KMT2A (0.40) | KDM4EHSD17B10ALDH1A1MAPK1TDP1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108948035-A | A kind of dianhydride compound and the preparation method and application thereof of the rigidity alicyclic ring containing fluorine structure | 华中科技大学 | 2018-12-07 | — | — | CN | claimed |
| CN-114057762-A | Rigid alicyclic ketone anhydride compound and preparation method and application thereof | 华中科技大学 | 2022-02-18 | — | — | CN | disclosed |
| CN-106660919-B | Preparation of 2, 6-and 2, 7-disubstituted anthraquinone derivatives | 巴斯夫欧洲公司 | 2019-10-11 | — | — | CN | disclosed |
| CN-106660918-B | Preparation of 2, 6-and 2, 7-disubstituted anthraquinone derivatives | 巴斯夫欧洲公司 | 2019-10-11 | — | — | CN | disclosed |
| CN-108948035-A | A kind of dianhydride compound and the preparation method and application thereof of the rigidity alicyclic ring containing fluorine structure | 华中科技大学 | 2018-12-07 | — | — | CN | disclosed |
| CN-106660919-A | preparation of 2, 6-and 2, 7-disubstituted anthraquinone derivatives | 巴斯夫欧洲公司 | 2017-05-10 | — | — | CN | disclosed |
| CN-106660918-A | preparation of 2, 6-and 2, 7-disubstituted anthraquinone derivatives | 巴斯夫欧洲公司 | 2017-05-10 | — | — | CN | disclosed |