Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR2 | O60603 | 2/20 | 0.42 |
| ▸ | CTSS | P25774 | 4/20 | 0.42 |
| ▸ | CTSL | P07711 | 3/20 | 0.42 |
| ▸ | CTSB | P07858 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3339610 | 0.84 | TLR2 (0.47) | TLR2CTSSCTSLCTSBLMNA | |
| SCHEMBL3333808 | 0.84 | TLR2 (0.47) | TLR2CTSSCTSLCTSBLMNA | |
| Hydrochloric Acid SCHEMBL19641048 | 0.84 | TLR2 (0.47) | TLR2CTSSCTSLCTSBLMNA | |
| SCHEMBL605067 | 0.83 | TLR2 (0.45) | TLR2CTSSCTSLCTSBLMNA | |
| Hydrochloric Acid SCHEMBL19641072 | 0.81 | TLR2 (0.46) | TLR2CTSSCTSLCTSBLMNA | |
| SCHEMBL31708737 | 0.81 | TLR2 (0.44) | TLR2CTSSCTSLCTSBLMNA | |
| SCHEMBL607996 | 0.81 | CTSB (0.46) | TLR2CTSSCTSLCTSBLMNA | |
| SCHEMBL28172950 | 0.80 | CTSB (0.40) | CTSSCTSLCTSBLMNASMN1; SMN2 | |
| SCHEMBL29197029 | 0.80 | TLR2 (0.43) | TLR2CTSSCTSLCTSBLMNA | |
| SCHEMBL23387355 | 0.79 | CTSB (0.44) | TLR2CTSSCTSLCTSBLMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107108625-A | Spirocyclic derivatives | 克罗诺斯治疗有限公司 | 2017-08-29 | — | — | CN | disclosed |