Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10874170 | 0.91 | HDAC1 (0.39) | HDAC1HDAC3HDAC4HDAC7HDAC2 | |
| SCHEMBL10721880 | 0.84 | HDAC1 (0.43) | HDAC1HDAC2OPRM1OPRK1TSHR | |
| SCHEMBL10643944 | 0.84 | ALDH1A1 (0.39) | HDAC1HDAC2OPRM1OPRD1OPRK1 | |
| SCHEMBL10770025 | 0.84 | HDAC1 (0.38) | HDAC1HDAC3HDAC4HDAC7HDAC2 | |
| SCHEMBL10721549 | 0.83 | ALDH1A1 (0.38) | HDAC1HDAC2HDAC11HDAC8HDAC6 | |
| SCHEMBL11179902 | 0.79 | ALDH1A1 (0.46) | HDAC1HDAC2OPRM1OPRD1TSHR | |
| SCHEMBL10544600 | 0.78 | ALDH1A1 (0.40) | HDAC1HDAC2OPRM1OPRD1TSHR | |
| SCHEMBL9685758 | 0.77 | HDAC1 (0.43) | HDAC1HDAC2OPRM1OPRD1TSHR | |
| SCHEMBL10543701 | 0.76 | ALDH1A1 (0.39) | HDAC1HDAC2HDAC11HDAC8HDAC6 | |
| SCHEMBL10643935 | 0.75 | ALDH1A1 (0.39) | HDAC1HDAC2OPRM1OPRD1TSHR |
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-0191989-A1 | Antibiotic isoxazole derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1986-08-27 | — | — | EP | disclosed |