Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.56 |
| ▸ | AGXT | P21549 | 2/20 | 0.56 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.47 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 11/20 | 0.46 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.46 |
| ▸ | MMP1 | P03956 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MMP12 | P39900 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL775797 | 0.82 | IDO1 (0.58) | IDO1AGXTNR4A2HCAR2MAOB | |
| SCHEMBL9861115 | 0.81 | CYP3A4 (0.58) | IDO1AGXTNR4A2HCAR2MAOB | |
| SCHEMBL9861770 | 0.80 | IDO1 (0.56) | IDO1MAOBMMP2MMP9MMP12 | |
| SCHEMBL778647 | 0.79 | IDO1 (0.55) | IDO1AGXTNR4A2HCAR2MAOB | |
| SCHEMBL28736694 | 0.79 | IDO1 (0.55) | IDO1AGXTNR4A2HCAR2MAOB | |
| SCHEMBL10859327 | 0.79 | IDO1 (0.50) | IDO1AGXTNR4A2MAOBPARP10 | |
| SCHEMBL9861104 | 0.79 | AGXT (0.57) | AGXTNR4A2MMP1MMP2MMP9 | |
| Ammonia Solution, Strong SCHEMBL28883022 | 0.79 | IDO1 (0.50) | IDO1AGXTNR4A2HCAR2MAOB | |
| SCHEMBL5078811 | 0.78 | CA2 (0.59) | IDO1AGXTMMP1MMP2MMP9 | |
| SCHEMBL777170 | 0.78 | IDO1 (0.53) | IDO1AGXTNR4A2HCAR2MAOB |
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-113651863-B | Unsaturated thioglycoside compound and selective synthesis method and application thereof | 华东师范大学 | 2023-11-10 | — | — | CN | disclosed |
| CN-113651863-A | Unsaturated thioglycoside compound and selective synthesis method and application thereof | 华东师范大学 | 2021-11-16 | — | — | CN | disclosed |
| EP-0150168-B1 | USE OF METAL SALTS OF THIOSULPHURIC -S-ESTERS AS RUBBER/METAL BONDING PROMOTERS | MONSANTO EUROPE S.A./N.V. (BE) | 1991-05-08 | — | — | EP | disclosed |
| US-4581297-A | STEEL BELTED RADIAL TIRES | MONSANTO EUROPE, S.A. (BE) | 1986-04-08 | — | — | US | disclosed |
| EP-0150168-A2 | Use of metal salts of thiosulphuric -S-esters as rubber/metal bonding promoters | MONSANTO EUROPE S.A./N.V. (BE) | 1985-07-31 | — | — | EP | disclosed |