Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.64 |
| ▸ | XDH | P47989 | 3/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ACLY | P53396 | 1/20 | 0.43 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30786304 | 0.82 | ALDH1A1 (0.75) | ALDH1A1XDHKDM4EPKMHPGD | |
| SCHEMBL13113066 | 0.80 | ALDH1A1 (1.00) | ALDH1A1XDHKDM4EPKMHPGD | |
| SCHEMBL26927919 | 0.79 | ALDH1A1 (0.55) | ALDH1A1XDHKDM4EPKMHPGD | |
| SCHEMBL3396645 | 0.74 | XDH (0.77) | ALDH1A1XDHKDM4EPKMGPR35 | |
| SCHEMBL30786295 | 0.71 | XDH (0.59) | ALDH1A1XDHKDM4EPKMACLY | |
| SCHEMBL25577619 | 0.70 | PAX8 (0.50) | TDP1MEN1KMT2AL3MBTL1 | |
| SCHEMBL13113067 | 0.70 | ALDH1A1 (0.52) | ALDH1A1KDM4EHSD17B10LMNAMAPT | |
| SCHEMBL21941741 | 0.70 | ALDH1A1 (0.79) | ALDH1A1XDHKDM4EPKMHPGD | |
| SCHEMBL20522397 | 0.70 | ALDH1A1 (0.47) | ALDH1A1KDM4EHSD17B10TDP1MEN1 | |
| SCHEMBL21880473 | 0.70 | ALDH1A1 (0.79) | ALDH1A1XDHKDM4EPKMHPGD |
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-2023237015-A1 | N-TETRAZOLYL ARYL UREA DERIVATIVES, PREPARATION METHOD THEREFOR, AND USE THEREOF | 杭州壹瑞医药科技有限公司 | 2023-12-14 | — | — | WO | disclosed |