Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.38 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | FLT3 | P36888 | 1/20 | 0.36 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.35 |
| ▸ | RXRB | P28702 | 1/20 | 0.35 |
| ▸ | RXRG | P48443 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.34 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | CTSC | P53634 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL22872137 | 0.77 | PTPN1 (0.38) | GRIN1GRIN2BKDM4EHSD17B1HSD17B2 | |
| SCHEMBL21774325 | 0.74 | FLT3 (0.41) | TNFGRIN1GRIN2BMMP3FLT3 | |
| SCHEMBL28730712 | 0.73 | RXRA (0.40) | TNFMMP3FLT3PDPK1RXRA | |
| SCHEMBL16865662 | 0.72 | TSHR (0.40) | GRIN1GRIN2BHDAC1HDAC6KDM4E | |
| SCHEMBL13742991 | 0.72 | ENPP1 (0.40) | HDAC1HDAC6HSD17B1HSD17B2DAO | |
| SCHEMBL145588 | 0.72 | DAO (0.37) | GRIN1GRIN2BHDAC1HDAC6HSD17B1 | |
| SCHEMBL2267261 | 0.72 | KIF11 (0.57) | RXRARXRBRXRGDAO | |
| SCHEMBL18954357 | 0.72 | IKBKB (0.44) | GRIN1GRIN2BHDAC6HSD17B1HSD17B2 | |
| SCHEMBL21021174 | 0.71 | MAOB (0.59) | MMP3FLT3RXRARXRBRXRG | |
| SCHEMBL22872105 | 0.70 | ENPP1 (0.39) | GRIN1GRIN2BHDAC1HDAC6HSD17B1 |
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-113613652-B | Benzimidazole compounds and their use in the treatment of alzheimer's disease or huntington's disease | 台湾卫生研究院 | 2022-08-23 | — | — | CN | disclosed |
| CN-113613652-A | Benzimidazole compounds and their use for treating alzheimer's disease or huntington's disease | 台湾卫生研究院 | 2021-11-05 | — | — | CN | disclosed |