Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | BCL9 | O00512 | 1/20 | 0.42 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Ethylene Glycol SCHEMBL28356619 | 0.88 | TSHR (0.50) | ALDH1A1MAPK1CA1CA2CES2 | |
| SCHEMBL8433 | 0.82 | HSPB1 (0.52) | ALDH1A1LMNACYP3A4SMN1; SMN2TP53 | |
| SCHEMBL28135398 | 0.81 | HSPB1 (0.50) | ALDH1A1LMNACYP3A4SMN1; SMN2TP53 | |
| Ammonia Solution, Strong SCHEMBL27663814 | 0.81 | HSPB1 (0.50) | ALDH1A1LMNACYP3A4SMN1; SMN2TP53 | |
| Hydrochloric Acid SCHEMBL27912110 | 0.81 | HSPB1 (0.50) | ALDH1A1LMNACYP3A4SMN1; SMN2TP53 | |
| Hydrazine SCHEMBL27959578 | 0.77 | CA1 (0.50) | ALDH1A1LMNACYP3A4SMN1; SMN2TP53 | |
| SCHEMBL28285987 | 0.77 | LMNA (0.47) | ALDH1A1LMNACYP3A4SMN1; SMN2TP53 | |
| 2-Methoxyethanol SCHEMBL29186967 | 0.75 | POLB (0.49) | ALDH1A1SMN1; SMN2MAPK1TSHRMEN1 | |
| SCHEMBL56460 | 0.74 | MAPT (0.58) | ALDH1A1LMNAPTGS2TSHRMAPT | |
| SCHEMBL11583343 | 0.73 | TSHR (0.49) | MAPK1CA1CA2CES2CES1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112245408-A | Light-controlled release antibacterial peptide nanoparticle and preparation method and application thereof | 华南理工大学 | 2021-01-22 | — | — | CN | disclosed |
| CN-112245408-A | Light-controlled release antibacterial peptide nanoparticle and preparation method and application thereof | 华南理工大学 | 2021-01-22 | — | — | CN | disclosed |
| CN-112023044-A | Near-infrared light and pH dual-response oleic acid derivative nano drug-loaded material and preparation method and application thereof | 华南理工大学 | 2020-12-04 | — | — | CN | disclosed |