Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | GAA | P10253 | 4/20 | 0.56 |
| ▸ | HTT | P42858 | 3/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.56 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.40 |
| ▸ | FEN1 | P39748 | 1/20 | 0.40 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.40 |
| ▸ | PARP15 | Q460N3 | 3/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 3/20 | 0.39 |
| ▸ | TNKS2 | Q9H2K2 | 3/20 | 0.39 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.39 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.39 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MMP12 | P39900 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29922978 | 1.00 | ALDH1A1 (0.56) | ALDH1A1GAAHTTKDM4ENPSR1 | |
| SCHEMBL14672079 | 0.82 | ALDH1A1 (0.67) | ALDH1A1GAAHTTKDM4ENPSR1 | |
| SCHEMBL22451332 | 0.81 | KDM4E (0.67) | ALDH1A1GAAHTTKDM4ENPSR1 | |
| SCHEMBL28899887 | 0.76 | THRB (0.50) | GAAHTTERCC1FEN1ERCC4 | |
| SCHEMBL28899808 | 0.75 | THRA (0.50) | ERCC1FEN1ERCC4 | |
| SCHEMBL29923141 | 0.75 | THRA (0.50) | ERCC1FEN1ERCC4 | |
| SCHEMBL3583941 | 0.74 | ALDH1A1 (0.68) | ALDH1A1GAAHTTKDM4ENPSR1 | |
| SCHEMBL3580260 | 0.73 | ALDH1A1 (1.00) | ALDH1A1GAAHTTKDM4ENPSR1 | |
| SCHEMBL13440423 | 0.73 | ALDH1A1 (0.67) | ALDH1A1GAAHTTKDM4ENPSR1 | |
| SCHEMBL22441918 | 0.70 | ALDH1A1 (0.69) | ALDH1A1GAAHTTKDM4ENPSR1 |
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-107382986-B | 4-hydroxy-1-methylisoquinoline derivatives and their use in increasing endogenous erythropoietin | 江苏艾立康医药科技有限公司 | 2022-09-20 | — | — | CN | disclosed |