Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | PNMT | P11086 | 2/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MAP2K7 | O14733 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 2/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 2/20 | 0.37 |
| ▸ | GBA1 | P04062 | 1/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
| ▸ | XDH | P47989 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | PKLR | P30613 | 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 | |
|---|---|---|---|---|
| SCHEMBL29190572 | 1.00 | MAPK1 (0.43) | MAPK1DAOPNMTADRA2AMAPT | |
| SCHEMBL30833670 | 0.83 | HTT (0.54) | DAOPNMTADRA2AMAPTHPGD | |
| SCHEMBL30833712 | 0.78 | MAPK1 (0.44) | MAPK1GSK3B | |
| SCHEMBL29190564 | 0.78 | MAPK1 (0.44) | MAPK1GSK3B | |
| SCHEMBL30833685 | 0.78 | MAPK1 (0.52) | MAPK1MAPTHPGDLMNACYP1A2 | |
| SCHEMBL29190669 | 0.78 | MAPK1 (0.52) | MAPK1MAPTHPGDLMNACYP1A2 | |
| SCHEMBL30833799 | 0.78 | SIRT6 (0.50) | MAPK1MAPTHPGDCYP3A4LMNA | |
| SCHEMBL4784574 | 0.78 | SIRT6 (0.50) | MAPK1MAPTHPGDCYP3A4LMNA | |
| SCHEMBL1489156 | 0.73 | MAPT (0.47) | DAOMAPTHPGDMAP2K7CYP3A4 | |
| SCHEMBL22445861 | 0.71 | MAPT (0.47) | MAPTHPGDLMNACDK2PKM |
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-113896744-B | Selective EGFR inhibitor | 成都先导药物开发股份有限公司 | 2024-04-16 | — | — | CN | disclosed |