Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.41 |
| ▸ | LOX | P28300 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.35 |
| ▸ | RAD52 | P43351 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.34 |
| ▸ | ANPEP | P15144 | 1/20 | 0.33 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9134930 | 0.84 | KMT2A (0.35) | POLBMEN1KMT2A | |
| SCHEMBL12668631 | 0.78 | POLB (0.42) | POLBSMN1; SMN2CXCR4LOXHSD17B10 | |
| SCHEMBL616071 | 0.78 | POLB (0.42) | POLBSMN1; SMN2CXCR4LOXHSD17B10 | |
| SCHEMBL342435 | 0.78 | POLB (0.42) | POLBSMN1; SMN2CXCR4LOXHSD17B10 | |
| SCHEMBL10729611 | 0.77 | POLB (0.41) | POLBSMN1; SMN2CXCR4LOXHSD17B10 | |
| SCHEMBL10823163 | 0.77 | POLB (0.41) | POLBSMN1; SMN2CXCR4LOXHSD17B10 | |
| Hydrochloric Acid SCHEMBL1155904 | 0.77 | POLB (0.41) | POLBSMN1; SMN2CXCR4LOXHSD17B10 | |
| Hydrochloric Acid SCHEMBL27646208 | 0.77 | POLB (0.41) | POLBSMN1; SMN2CXCR4LOXHSD17B10 | |
| Piperazine SCHEMBL28245279 | 0.77 | CXCR4 (0.44) | POLBSMN1; SMN2CXCR4LOXHSD17B10 | |
| SCHEMBL7618304 | 0.77 | POLB (0.41) | POLBSMN1; SMN2CXCR4LOXHSD17B10 |
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-115467029-A | Chemical ring closure construction method of cyclic compound library and cyclic compound library | 亚飞（上海）生物医药科技有限公司 | 2022-12-13 | — | — | CN | disclosed |