Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP3 | P08254 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Ethane SCHEMBL28768900 | 0.96 | LMNA (0.43) | LMNAKDM4EALDH1A1CYP3A4GABRB3 | |
| SCHEMBL4642996 | 0.82 | LMNA (0.38) | LMNAKDM4EALDH1A1CYP3A4GABRB3 | |
| SCHEMBL4623915 | 0.79 | TDP1 (0.38) | LMNATDP1MMP2MMP3MMP9 | |
| SCHEMBL1980043 | 0.77 | MMP2 (0.42) | LMNATDP1MMP2MMP3MMP9 | |
| SCHEMBL4618645 | 0.76 | KDM4E (0.32) | LMNAKDM4EALDH1A1CYP3A4GABRB3 | |
| SCHEMBL9334278 | 0.70 | LMNA (0.56) | LMNAKDM4EALDH1A1CYP3A4GABRB3 | |
| SCHEMBL1404437 | 0.70 | LMNA (0.50) | LMNAKDM4EALDH1A1CYP3A4GABRB3 | |
| SCHEMBL11581950 | 0.70 | PYGB (0.31) | — | |
| SCHEMBL542612 | 0.68 | LMNA (0.48) | LMNAKDM4EALDH1A1CYP3A4GABRB3 | |
| SCHEMBL13209004 | 0.68 | LMNA (0.48) | LMNAKDM4EALDH1A1CYP3A4GABRB3 |
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-101184528-B | Permanent waving agent containing heterocyclic mercapto compound | SHOWA DENKO KK | 2010-12-29 | — | — | CN | disclosed |
| CN-101184528-A | Permanent waving agent containing heterocyclic mercapto compound | SHOWA DENKO KK (JP) | 2008-05-21 | — | — | CN | disclosed |
| US-4088751-A | SHAVING CREAM, SHAMPOO, LOTION, 2-THIO-4-OXYPYRIMIDINE OR THIOHYDANTOIN AND HYDROGEN PEROXIDE, EXOTHERMIC REDOX REACTION | COLGATE-PALMOLIVE COMPANY (US) | 1978-05-09 | — | — | US | disclosed |