Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 4/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | ERAP2 | Q6P179 | 2/20 | 0.32 |
| ▸ | LNPEP | Q9UIQ6 | 2/20 | 0.32 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | C1S | P09871 | 1/20 | 0.31 |
| ▸ | S100A4 | P26447 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6921023 | 0.78 | CSNK2A2 (0.38) | HPGDMAPK1TSHRATMNPSR1 | |
| SCHEMBL7983624 | 0.75 | HPGD (0.34) | POLBPKMHPGDMAPK1TSHR | |
| SCHEMBL6925163 | 0.73 | KEAP1 (0.47) | POLBPKMHPGDMAPK1TSHR | |
| SCHEMBL6925132 | 0.71 | KEAP1 (0.37) | PKMHPGDMAPK1TSHRATM | |
| SCHEMBL6920646 | 0.70 | ALDH1A1 (0.40) | HPGDMAPK1ALDH1A1KEAP1NFE2L2 | |
| SCHEMBL5839757 | 0.69 | KEAP1 (0.41) | HPGDMAPK1TSHRATMNPSR1 | |
| SCHEMBL7983629 | 0.68 | CSNK2A2 (0.31) | KEAP1NFE2L2C1S | |
| SCHEMBL6925185 | 0.67 | KDM4E (0.48) | HPGDMAPK1TSHRATMNPSR1 | |
| SCHEMBL6923952 | 0.66 | KEAP1 (0.41) | PKMHPGDMAPK1TSHRATM | |
| SCHEMBL7983631 | 0.66 | ALDH1A1 (0.33) | HPGDMAPK1TSHRATMNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6291514-B1 | Heteroaryl amidines, methylamidines and guanidines, preparation thereof, and use thereof as protease inhibitors | 3-DIMENSIONAL PHARMACEUTICALS, INC. | 2001-09-18 | — | — | US | disclosed |