Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.35 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.35 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.35 |
| ▸ | ERN1 | O75460 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4766733 | 0.86 | NAMPT (0.42) | HPGDALDH1A1GAAEGFRERBB2 | |
| SCHEMBL6288870 | 0.82 | BDKRB2 (0.44) | HPGDALDH1A1HSD17B3CNR2HTR7 | |
| SCHEMBL8979672 | 0.81 | HPGD (0.42) | HPGDALDH1A1SMN1; SMN2ERN1KIF11 | |
| SCHEMBL28435445 | 0.81 | KMT2A (0.44) | HPGDSMN1; SMN2GAAHSD17B3HTR7 | |
| SCHEMBL2480571 | 0.81 | RARB (0.50) | ALDH1A1 | |
| SCHEMBL8979697 | 0.79 | MAPK1 (0.46) | ALDH1A1SMN1; SMN2EPHX2HSD17B3TLR8 | |
| SCHEMBL4766583 | 0.78 | HSD17B3 (0.55) | HPGDSMN1; SMN2HSD17B3HTR7 | |
| SCHEMBL1983658 | 0.78 | TSHR (0.32) | — | |
| SCHEMBL30758056 | 0.77 | KMT2A (0.40) | HPGDALDH1A1SMN1; SMN2EPHX2TRPV1 | |
| SCHEMBL961840 | 0.77 | MAPT (0.47) | ALDH1A1HDAC3HDAC1HDAC2HDAC8 |
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 |
|---|---|---|---|---|---|---|---|
| US-5258509-A | Catalytic detherification and alkylation | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1993-11-02 | — | — | US | disclosed |