Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | KLK7 | P49862 | 3/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL28208913 | 0.98 | ALDH1A1 (0.49) | ALDH1A1HPGDEPHX2MEN1KMT2A | |
| SCHEMBL12561124 | 0.96 | ALDH1A1 (0.43) | ALDH1A1HPGDEPHX2MEN1KMT2A | |
| SCHEMBL28208891 | 0.92 | TSHR (0.42) | ALDH1A1HPGDEPHX2MEN1KMT2A | |
| SCHEMBL12561206 | 0.89 | EPHX2 (0.43) | ALDH1A1HPGDEPHX2 | |
| SCHEMBL697221 | 0.86 | ALDH1A1 (0.50) | ALDH1A1HPGDEPHX2MEN1KMT2A | |
| SCHEMBL9130829 | 0.84 | HPGD (0.53) | ALDH1A1HPGDEPHX2MEN1KMT2A | |
| SCHEMBL2907816 | 0.84 | HPGD (0.53) | ALDH1A1HPGDEPHX2MEN1KMT2A | |
| SCHEMBL5313576 | 0.84 | MGAM (0.47) | ALDH1A1HPGDMEN1KMT2AMAPT | |
| SCHEMBL4672743 | 0.82 | MEN1 (0.46) | ALDH1A1HPGDMEN1KMT2AMAPT | |
| SCHEMBL8123634 | 0.82 | MEN1 (0.46) | ALDH1A1HPGDMEN1KMT2AMAPT |
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-107848953-A | Fused rings γ amino acid derivativges and preparation method thereof and application in medicine | 四川海思科制药有限公司 | 2018-03-27 | — | — | CN | disclosed |