Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCC4 | O15439 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | RXRA | P19793 | 7/20 | 0.36 |
| ▸ | RXRB | P28702 | 7/20 | 0.36 |
| ▸ | RXRG | P48443 | 6/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.33 |
| ▸ | QPCT | Q16769 | 1/20 | 0.33 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28759860 | 0.82 | — | — | |
| SCHEMBL28807790 | 0.81 | BCL2L1 (0.33) | TSHRRXRARXRBCA2ALDH1A1 | |
| SCHEMBL28332937 | 0.81 | BCL2L1 (0.33) | TSHRRXRARXRBCA2ALDH1A1 | |
| SCHEMBL28351381 | 0.81 | BCL2L1 (0.33) | TSHRRXRARXRBCA2ALDH1A1 | |
| SCHEMBL11337785 | 0.81 | BCL2L1 (0.33) | TSHRRXRARXRBCA2ALDH1A1 | |
| SCHEMBL29138302 | 0.81 | ALOX15 (0.39) | TSHRFFAR1MEN1KMT2AALDH1A1 | |
| SCHEMBL27842424 | 0.81 | HRH3 (0.37) | — | |
| SCHEMBL28973039 | 0.81 | NPC1 (0.31) | GAAPOLB | |
| SCHEMBL28167830 | 0.78 | MKNK1 (0.35) | CA2KMT2AALDH1A1 | |
| SCHEMBL28295369 | 0.77 | ESR1 (0.30) | — |
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-113231032-B | MoS2QDs @ Zr-MOF/Co doped Fe3O4Boron isotope adsorbent and preparation method thereof | 中国科学院青海盐湖研究所 | 2022-04-12 | — | — | CN | claimed |
| CN-113231032-A | MoS2QDs @ Zr-MOF/Co doped Fe3O4Boron isotope adsorbent and preparation method thereof | 中国科学院青海盐湖研究所 | 2021-08-10 | — | — | CN | claimed |