Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DDB1 | Q16531 | 1/20 | 0.44 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.43 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TGM2 | P21980 | 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 | |
|---|---|---|---|---|
| SCHEMBL11178569 | 0.86 | TDP1 (0.49) | L3MBTL1SLC6A3TDP1LMNATGM2 | |
| SCHEMBL11183707 | 0.84 | HTT (0.37) | DDB1CRBNKMT2A | |
| SCHEMBL11175155 | 0.83 | IDH1 (0.39) | DDB1CRBNCYP17A1CYP19A1KMT2A | |
| SCHEMBL11178572 | 0.82 | TDP1 (0.47) | L3MBTL1SLC6A3TDP1LMNATGM2 | |
| SCHEMBL11193383 | 0.81 | SLC1A3 (0.39) | CYP17A1CYP19A1MAPK1KMT2A | |
| SCHEMBL16865212 | 0.80 | CYP17A1 (0.37) | ALDH1A1CYP17A1CYP19A1SLC6A2SLC6A3 | |
| SCHEMBL11183712 | 0.79 | HTT (0.36) | DDB1CRBNKMT2A | |
| SCHEMBL11175156 | 0.79 | IDH1 (0.38) | DDB1CRBNCYP17A1CYP19A1KMT2A | |
| SCHEMBL28999973 | 0.79 | CTSL (0.41) | DDB1CRBNALDH1A1HCAR2CYP17A1 | |
| SCHEMBL32674103 | 0.78 | ALDH1A1 (0.53) | DDB1CRBNALDH1A1CYP17A1CYP19A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113121357-B | 2-nitrovinyl cyclopropane compound and synthesis method thereof | 上海大学 | 2023-05-16 | — | — | CN | disclosed |
| US-11479867-B2 | Electrocatalytic alkene diazidation | CORNELL UNIVERSITY (US) | 2022-10-25 | — | — | US | disclosed |
| CN-113121357-A | 2-nitrovinyl cyclopropane compound and synthetic method thereof | 上海大学 | 2021-07-16 | — | — | CN | disclosed |