Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.54 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.50 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.46 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.46 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1098277 | 0.84 | EGLN1 (0.65) | ALDH1A1EGLN1TDP1KMT2ASLC6A2 | |
| SCHEMBL28396741 | 0.84 | ALDH1A1 (0.55) | ALDH1A1EGLN1TDP1KMT2ASLC6A2 | |
| SCHEMBL31106173 | 0.84 | EGLN1 (0.65) | ALDH1A1EGLN1TDP1KMT2ASLC6A2 | |
| SCHEMBL7631724 | 0.82 | ALDH1A1 (0.58) | ALDH1A1EGLN1TDP1KMT2ASLC6A2 | |
| SCHEMBL2200965 | 0.82 | CDC25B (0.60) | ALDH1A1TDP1KMT2ATSHRL3MBTL1 | |
| SCHEMBL3048365 | 0.81 | ALDH1A1 (0.65) | ALDH1A1EGLN1TDP1KMT2ASLC6A2 | |
| SCHEMBL1681013 | 0.81 | EGLN1 (0.55) | ALDH1A1EGLN1TDP1KMT2ASLC6A2 | |
| SCHEMBL6665902 | 0.81 | ALDH1A1 (0.68) | ALDH1A1EGLN1TDP1KMT2ASLC6A2 | |
| SCHEMBL27891487 | 0.79 | ALDH1A1 (0.58) | ALDH1A1EGLN1TDP1KMT2ASLC6A2 | |
| SCHEMBL7631721 | 0.79 | ALDH1A1 (0.58) | ALDH1A1EGLN1TDP1KMT2ASLC6A2 |
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-116988078-A | Metal catalyzed asymmetric coupling method promoted by electrochemical reduction | 中国科学院上海有机化学研究所 | 2023-11-03 | — | — | CN | disclosed |