Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | IKBKB | O14920 | 1/20 | 0.44 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | STAT3 | P40763 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | PTPRA | P18433 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | MGAM | O43451 | 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 | |
|---|---|---|---|---|
| SCHEMBL902623 | 0.84 | ALDH1A1 (0.66) | HDAC1HDAC6ALDH1A1HPGDGLA | |
| SCHEMBL30661004 | 0.83 | IKBKB (0.60) | HDAC1HDAC6ALDH1A1HPGDGLA | |
| SCHEMBL461849 | 0.83 | IKBKB (0.60) | HDAC1HDAC6ALDH1A1HPGDGLA | |
| SCHEMBL27448248 | 0.82 | HDAC1 (0.46) | HDAC1HDAC6ALDH1A1HPGDGLA | |
| Hydrochloric Acid SCHEMBL31161184 | 0.81 | IKBKB (0.58) | HDAC1HDAC6ALDH1A1HPGDGLA | |
| SCHEMBL28276351 | 0.81 | IKBKB (0.58) | HDAC1HDAC6ALDH1A1HPGDGLA | |
| SCHEMBL28383030 | 0.80 | ALDH1A1 (0.70) | ALDH1A1GLAMAPTACHEKDM4E | |
| SCHEMBL10525572 | 0.80 | HDAC1 (0.63) | HDAC1HDAC6ALDH1A1HPGDGLA | |
| SCHEMBL3535241 | 0.79 | ALDH1A1 (0.51) | ALDH1A1HPGDGLAMAPTACHE | |
| SCHEMBL7030506 | 0.79 | KDM4E (0.56) | HDAC1HDAC6ALDH1A1HPGDAOX1 |
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-211586555-U | Reaction kettle for preparing acyl chloride compounds | 长春百纯和成医药科技有限公司 | 2020-09-29 | — | — | CN | disclosed |