Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 1/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.48 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.48 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.48 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.48 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.48 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.48 |
| ▸ | MAPK14 | Q16539 | 7/20 | 0.47 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.45 |
| ▸ | PLK1 | P53350 | 1/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.44 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL17847332 | 0.88 | MAPK14 (0.57) | ACACBHDAC3HDAC6HDAC4HDAC1 | |
| SCHEMBL25064142 | 0.86 | HDAC6 (0.49) | ACACBHDAC3HDAC6HDAC4HDAC1 | |
| SCHEMBL17847319 | 0.82 | HDAC6 (0.57) | ACACBHDAC3HDAC6MAPK14PLK1 | |
| SCHEMBL13484343 | 0.81 | HDAC6 (0.63) | HDAC6PLK1POLBMMP13MLYCD | |
| SCHEMBL25064145 | 0.75 | HDAC6 (0.49) | ACACBHDAC3HDAC6HDAC4HDAC1 | |
| SCHEMBL104788 | 0.75 | MAPK14 (0.56) | ACACBHDAC3HDAC6HDAC4HDAC1 | |
| SCHEMBL21907222 | 0.74 | MAPK14 (0.52) | ACACBHDAC3HDAC6HDAC4HDAC1 | |
| SCHEMBL8269158 | 0.74 | HDAC3 (0.50) | ACACBHDAC3HDAC6HDAC4HDAC1 | |
| SCHEMBL1169741 | 0.73 | MAPK14 (0.54) | ACACBHDAC3HDAC6HDAC4HDAC1 | |
| SCHEMBL13972889 | 0.73 | PLK1 (0.55) | ACACBHDAC3MAPK14PLK1POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-4119546-A1 | BIFUNCTIONAL COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF | Suzhou Kintor Pharmaceuticals, Inc. (CN) | 2023-01-18 | — | — | EP | disclosed |