Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERCC5 | P28715 | 3/20 | 0.60 |
| ▸ | FEN1 | P39748 | 3/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | MMP1 | P03956 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | SRD5A2 | P31213 | 4/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.47 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.47 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL5750062 | 0.89 | LMNA (0.52) | ERCC5FEN1SMN1; SMN2MMP1ALDH1A1 | |
| SCHEMBL2645447 | 0.87 | ALDH1A1 (0.61) | ERCC5FEN1SMN1; SMN2ALDH1A1MAPK1 | |
| SCHEMBL5370096 | 0.86 | ALDH1A1 (0.56) | SMN1; SMN2ALDH1A1MAPK1L3MBTL1HPGD | |
| SCHEMBL5752818 | 0.84 | OPRM1 (0.45) | ERCC5FEN1SMN1; SMN2ALDH1A1MAPK1 | |
| SCHEMBL10252731 | 0.83 | ALDH1A1 (0.53) | SMN1; SMN2ALDH1A1MAPK1L3MBTL1HPGD | |
| SCHEMBL12159688 | 0.83 | KMT2A (0.58) | SMN1; SMN2ALDH1A1MAPK1L3MBTL1HPGD | |
| SCHEMBL5753439 | 0.83 | ERCC5 (0.62) | ERCC5FEN1SMN1; SMN2MMP1ALDH1A1 | |
| SCHEMBL13748438 | 0.83 | NPC1 (0.62) | SMN1; SMN2ALDH1A1MAPK1L3MBTL1HPGD | |
| SCHEMBL5754659 | 0.82 | RAB9A (0.59) | SMN1; SMN2ALDH1A1MAPK1L3MBTL1HPGD | |
| SCHEMBL5750647 | 0.81 | P4HTM (0.53) | ERCC5FEN1SMN1; SMN2ALDH1A1MAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111499572-B | Preparation method of intermediate of roxasistat | 安徽省庆云医药股份有限公司 | 2022-04-01 | — | — | CN | disclosed |
| CN-111499572-A | Preparation method of intermediate of roxasistat | 安徽省庆云医药股份有限公司 | 2020-08-07 | — | — | CN | disclosed |