Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERCC1 | P07992 | 1/20 | 0.58 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.58 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.57 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.54 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.53 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.53 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.51 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | PPARG | P37231 | 1/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL11205535 | 0.86 | ERCC1 (0.69) | ERCC1ERCC4HDAC6HDAC1ALDH1A1 | |
| SCHEMBL3459872 | 0.85 | ERCC1 (0.65) | ERCC1ERCC4HDAC6HDAC1ALDH1A1 | |
| SCHEMBL28893791 | 0.81 | ERCC1 (0.73) | ERCC1ERCC4HDAC6HDAC1HDAC2 | |
| SCHEMBL457082 | 0.80 | HDAC6 (0.79) | ERCC1ERCC4HDAC6HDAC1ALDH1A1 | |
| SCHEMBL1155517 | 0.79 | ALDH1A1 (0.72) | ERCC1ERCC4HDAC6HDAC1ALDH1A1 | |
| SCHEMBL678515 | 0.79 | CA2 (0.71) | EPHX2NR1H4 | |
| SCHEMBL11901042 | 0.79 | HDAC6 (0.70) | ERCC1ERCC4HDAC6HDAC1ALDH1A1 | |
| SCHEMBL3462286 | 0.79 | HDAC2 (0.60) | ERCC1ERCC4HDAC6ALDH1A1HDAC2 | |
| SCHEMBL3567896 | 0.78 | TSHR (0.44) | ALDH1A1TSHREPHX2NR1H4 | |
| Hydrochloric Acid SCHEMBL3757721 | 0.78 | HDAC6 (0.76) | ERCC1ERCC4HDAC6HDAC1ALDH1A1 |
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-119528816-A | PARP-1 inhibitor and preparation method thereof | 吉林省药物研究院 | 2025-02-28 | — | — | CN | disclosed |