Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Propionic Acid SCHEMBL23069582 | 0.87 | TSHR (0.56) | TSHRRAB9ASMN1; SMN2GAAKDM4E | |
| Methyl Alcohol SCHEMBL9135360 | 0.82 | TSHR (0.53) | TSHRRAB9ASMN1; SMN2GAAKDM4E | |
| SCHEMBL10141203 | 0.82 | — | — | |
| SCHEMBL21114388 | 0.82 | TSHR (0.57) | TSHRRAB9ASMN1; SMN2GAAKDM4E | |
| SCHEMBL10141202 | 0.82 | — | — | |
| SCHEMBL28298 | 0.82 | — | — | |
| Methylamine SCHEMBL27926120 | 0.81 | TSHR (0.52) | TSHRRAB9ASMN1; SMN2GAAKDM4E | |
| SCHEMBL17363100 | 0.80 | — | — | |
| Phosphine SCHEMBL30485793 | 0.80 | — | — | |
| Water SCHEMBL5567597 | 0.80 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107115340-B | Antituberculosis drug, preparation method and application thereof | 浙江大学 | 2019-12-31 | — | — | CN | claimed |
| CN-107115340-A | A kind of antituberculotic and its production and use | 浙江大学 | 2017-09-01 | — | — | CN | claimed |
| CN-117865945-A | 2-aldehyde pyrrole butyric acid derivative, preparation method and application thereof | 天津现代创新中药科技有限公司 | 2024-04-12 | — | — | CN | disclosed |
| CN-107115340-B | Antituberculosis drug, preparation method and application thereof | 浙江大学 | 2019-12-31 | — | — | CN | disclosed |
| CN-107115340-A | A kind of antituberculotic and its production and use | 浙江大学 | 2017-09-01 | — | — | CN | disclosed |
| CN-107115340-A | A kind of antituberculotic and its production and use | 浙江大学 | 2017-09-01 | — | — | CN | disclosed |