Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 5/20 | 0.44 |
| ▸ | CA1 | P00915 | 4/20 | 0.44 |
| ▸ | CA12 | O43570 | 3/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.44 |
| ▸ | CA7 | P43166 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | GMNN | O75496 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | FYN | P06241 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Pyrogallol SCHEMBL28070218 | 0.88 | CA1 (0.48) | CA2CA1CA12CA14CA7 | |
| Guaiacol SCHEMBL28300008 | 0.85 | TP53 (0.62) | CA2CA1CA12CA14CA7 | |
| Phenol SCHEMBL27397777 | 0.85 | CA12 (0.46) | CA2CA1CA12CA14CA7 | |
| Ethoxycarbonyl Group SCHEMBL27621789 | 0.84 | HTR1A (0.47) | CA2CA12NPC1RAB9AHIF1A | |
| 1-Naphthol SCHEMBL27502562 | 0.84 | CYP1A2 (0.57) | CA2CA1CA12CA14CA7 | |
| Phenol SCHEMBL28169757 | 0.83 | CA12 (0.44) | CA2CA1CA12CA14CA7 | |
| Hydroquinone SCHEMBL27658224 | 0.82 | ESR1 (0.47) | CA2CA1CA12CA14CA7 | |
| Naphthalene SCHEMBL27488215 | 0.82 | ALDH1A1 (0.40) | ALDH1A1LMNAKDM4EMAPTRAB9A | |
| Biphenyl SCHEMBL27961596 | 0.80 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2LMNAKDM4EMAPT | |
| Ethoxycarbonyl Group SCHEMBL28807583 | 0.79 | EGFR (0.40) | ALDH1A1LMNAKDM4EMAPTHPGD |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106632130-B | Furodiazole compound and its application in preparation prevention and/or treatment diabetes B drug | 中国科学院海洋研究所 | 2019-07-26 | — | — | CN | disclosed |
| CN-105801381-B | A kind of synthetic method of catechol compound | 北京大学 | 2018-07-03 | — | — | CN | disclosed |
| CN-106632130-A | Oxadiazole compound and application thereof to preparation of medicament for preventing and/or treating type 2 diabetes | 中国科学院海洋研究所 | 2017-05-10 | — | — | CN | disclosed |
| CN-106239686-A | High-density environment-friendly fiberboard added with bamboo fibers and preparation method thereof | 苏州佰思科节能环保科技有限公司 | 2016-12-21 | — | — | CN | disclosed |
| CN-105801381-A | Synthesis method for catechol compound | 北京大学 | 2016-07-27 | — | — | CN | disclosed |