Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | USP2 | O75604 | 1/20 | 0.59 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.58 |
| ▸ | BLM | P54132 | 1/20 | 0.57 |
| ▸ | MAOB | P27338 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | ACHE | P22303 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | CA12 | O43570 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | CA7 | P43166 | 1/20 | 0.54 |
| ▸ | CA9 | Q16790 | 1/20 | 0.54 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL28239988 | 0.98 | HPGD (0.63) | HPGDALDH1A1USP2SIGMAR1BLM | |
| SCHEMBL7129676 | 0.86 | HPGD (0.79) | HPGDALDH1A1USP2SIGMAR1BLM | |
| SCHEMBL252026 | 0.86 | HPGD (0.79) | HPGDALDH1A1USP2SIGMAR1BLM | |
| SCHEMBL3097152 | 0.85 | HPGD (0.66) | HPGDALDH1A1USP2SIGMAR1BLM | |
| SCHEMBL3097149 | 0.85 | HPGD (0.66) | HPGDALDH1A1USP2SIGMAR1BLM | |
| Hydrochloric Acid SCHEMBL1597472 | 0.84 | HPGD (0.76) | HPGDALDH1A1USP2SIGMAR1BLM | |
| SCHEMBL1938606 | 0.80 | HPGD (0.70) | HPGDALDH1A1USP2SIGMAR1BLM | |
| SCHEMBL27989163 | 0.80 | ALDH1A1 (0.85) | HPGDALDH1A1USP2SIGMAR1BLM | |
| SCHEMBL2614241 | 0.80 | HPGD (0.84) | HPGDALDH1A1USP2SIGMAR1BLM | |
| SCHEMBL4143492 | 0.79 | HPGD (0.68) | HPGDALDH1A1USP2SIGMAR1BLM |
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-105143202-B | Dithiocarboxylic acid esters having spermicidal activity and process for their preparation | 科学与工业研究委员会 | 2018-08-14 | — | — | CN | disclosed |