Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.48 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7056680 | 0.91 | TDP1 (0.62) | TDP1LMNAL3MBTL1MAPTNR4A2 | |
| SCHEMBL21396941 | 0.84 | TDP1 (0.57) | TDP1LMNAL3MBTL1MAPTNR4A2 | |
| SCHEMBL8107873 | 0.82 | RIPK1 (0.52) | LMNAL3MBTL1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL258372 | 0.82 | RIPK1 (0.52) | LMNAL3MBTL1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL991988 | 0.82 | RIPK1 (0.52) | LMNAL3MBTL1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL3077522 | 0.80 | TSHR (0.59) | TDP1LMNAL3MBTL1MAPTSMN1; SMN2 | |
| SCHEMBL7050949 | 0.80 | TSHR (0.59) | TDP1LMNAL3MBTL1MAPTSMN1; SMN2 | |
| SCHEMBL11661425 | 0.79 | TDP1 (0.52) | TDP1LMNAL3MBTL1MAPTNR4A2 | |
| SCHEMBL27913389 | 0.79 | L3MBTL1 (0.52) | TDP1LMNAL3MBTL1MAPTNR4A2 | |
| SCHEMBL5470948 | 0.78 | BCAT2 (0.55) | LMNAL3MBTL1SMN1; SMN2NPC1RAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109867593-B | Gamma-hydroxy ketone derivative and synthetic method thereof | 中国科学院大连化学物理研究所 | 2021-10-29 | — | — | CN | disclosed |
| US-7795166-B2 | Functional group-selective hydrogenation catalyst and functional group-selective hydrogenation method | N.E. CHEMCAT CORPORATION (JP) | 2010-09-14 | — | — | US | disclosed |
| US-20070155617-A1 | FUNCTIONAL GROUP-SELECTIVE HYDROGENATION CATALYST AND FUNCTIONAL GROUP-SELECTIVE HYDROGENATION METHOD | N. E. CHEMCAT CORPORATION (JP) | 2007-07-05 | — | — | US | disclosed |