Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | TTR | P02766 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.37 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7913347 | 0.83 | CYP2C19 (0.47) | ALDH1A1CYP2C19CYP2D6HSD17B10TRPA1 | |
| SCHEMBL28312162 | 0.81 | CYP2D6 (0.44) | ALDH1A1CYP2C19CYP2D6HSD17B10TRPA1 | |
| SCHEMBL28354538 | 0.81 | CYP2C19 (0.48) | ALDH1A1CYP2C19CYP2D6HSD17B10TRPA1 | |
| SCHEMBL4577934 | 0.81 | CYP2C19 (0.63) | ALDH1A1CYP2C19CYP2D6HSD17B10TRPA1 | |
| SCHEMBL17537125 | 0.79 | CYP2C19 (0.39) | ALDH1A1CYP2C19CYP2D6HSD17B10TRPA1 | |
| SCHEMBL27956615 | 0.78 | CYP2D6 (0.46) | ALDH1A1CYP2C19CYP2D6HSD17B10TRPA1 | |
| SCHEMBL28365356 | 0.78 | ALDH1A1 (0.44) | ALDH1A1CYP2C19CYP2D6HSD17B10TRPA1 | |
| SCHEMBL12884227 | 0.78 | CYP2D6 (0.47) | ALDH1A1CYP2C19CYP2D6HSD17B10HIF1A | |
| SCHEMBL3959121 | 0.78 | CYP2D6 (0.47) | ALDH1A1CYP2C19CYP2D6HSD17B10HIF1A | |
| SCHEMBL31092005 | 0.77 | ALDH1A1 (0.42) | ALDH1A1CYP2C19CYP2D6HSD17B10KMT2A |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115710199-B | Photooxidation reduction catalytic process | 深圳湾实验室坪山生物医药研发转化中心 | 2024-06-28 | — | — | CN | disclosed |
| CN-115850673-B | Preparation method of low molecular weight poly (gamma-butyrolactone) polyol | 青岛科技大学 | 2024-06-18 | — | — | CN | disclosed |
| CN-115710199-A | Photo-oxidation-reduction catalysis method | 深圳湾实验室坪山生物医药研发转化中心 | 2023-02-24 | — | — | CN | disclosed |
| CN-113387837-B | Photo-oxidation-reduction catalysis method | 深圳湾实验室坪山生物医药研发转化中心 | 2023-02-21 | — | — | CN | disclosed |
| CN-114404427-A | Prodrug compound and use thereof | 配体药物公司 | 2022-04-29 | — | — | CN | disclosed |
| CN-110177818-B | Polyurethane-based adhesive dispersions | 惠普发展公司，有限责任合伙企业 | 2022-04-08 | — | — | CN | disclosed |
| CN-110198965-B | Polyurethane-based adhesive dispersions | 惠普发展公司，有限责任合伙企业 | 2022-04-01 | — | — | CN | disclosed |
| CN-113387837-A | Photo-oxidation-reduction catalysis method | 深圳湾实验室坪山生物医药研发转化中心 | 2021-09-14 | — | — | CN | disclosed |