Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP2 | P50579 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | PTGES | O14684 | 2/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | CDK9 | P50750 | 2/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.40 |
| ▸ | CAMK2A | Q9UQM7 | 2/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL25738485 | 0.78 | PARP1 (0.38) | HPGDKDM4EALDH1A1GLAGAA | |
| SCHEMBL17941961 | 0.77 | METAP2 (0.47) | METAP2KDM4EALDH1A1MAPTCDK9 | |
| SCHEMBL31212369 | 0.77 | METAP2 (0.47) | METAP2KDM4EALDH1A1MAPTCDK9 | |
| SCHEMBL31353096 | 0.76 | GPR17 (0.45) | METAP2KDM4EALDH1A1HTTPARP1 | |
| SCHEMBL25986282 | 0.76 | CDK4 (0.44) | METAP2HPGDKDM4EALDH1A1LMNA | |
| SCHEMBL8162707 | 0.74 | RAB9A (0.48) | METAP2HPGDKDM4EALDH1A1MAPT | |
| SCHEMBL17942005 | 0.73 | METAP2 (0.41) | METAP2MAPTPARP1CDK4CCND1 | |
| SCHEMBL10153752 | 0.73 | PARP1 (0.56) | METAP2HPGDKDM4EALDH1A1LMNA | |
| SCHEMBL2798886 | 0.72 | KDM4E (0.62) | METAP2HPGDKDM4EALDH1A1GLA | |
| SCHEMBL29892996 | 0.72 | KDM4E (0.62) | METAP2HPGDKDM4EALDH1A1GLA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023109521-A1 | PARP INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF | 凯复(苏州)生物医药有限公司 | 2023-06-22 | — | — | WO | disclosed |