Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28664389 | 1.00 | HDAC4 (0.42) | HDAC4KMT2APOLBCYP3A4CYP1A2 | |
| SCHEMBL18212458 | 0.79 | HDAC4 (0.40) | HDAC4KMT2ACYP3A4CYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL28192427 | 0.78 | HDAC4 (0.40) | HDAC4KMT2ACYP3A4CYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL18205193 | 0.78 | HDAC4 (0.40) | HDAC4KMT2ACYP3A4CYP1A2CYP2D6 | |
| SCHEMBL18205141 | 0.77 | HDAC4 (0.53) | HDAC4KMT2ACYP3A4CYP1A2CYP2D6 | |
| SCHEMBL28668183 | 0.75 | DPP4 (0.36) | HDAC4 | |
| SCHEMBL28668186 | 0.75 | DPP4 (0.36) | HDAC4 | |
| SCHEMBL19124102 | 0.73 | CYP3A4 (0.45) | HDAC4CYP3A4CYP1A2CYP2D6KDM4E | |
| SCHEMBL3694792 | 0.72 | CYP3A4 (0.43) | KMT2ACYP3A4CYP1A2CYP2D6KDM4E | |
| SCHEMBL3694790 | 0.72 | CYP3A4 (0.43) | KMT2ACYP3A4CYP1A2CYP2D6KDM4E |
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-107735088-B | Histone deacetylase inhibitors, compositions and methods of use thereof | CHDI基金会股份有限公司 | 2021-11-02 | — | — | CN | disclosed |