Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | WDR5 | P61964 | 1/20 | 0.51 |
| ▸ | NCEH1 | Q6PIU2 | 2/20 | 0.51 |
| ▸ | LDHA | P00338 | 1/20 | 0.50 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.46 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.46 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
| ▸ | CNR1 | P21554 | 5/20 | 0.45 |
| ▸ | CNR2 | P34972 | 5/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | RARB | P10826 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | DHODH | Q02127 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3157876 | 0.98 | WDR5 (0.50) | WDR5NCEH1LDHANR4A1NR4A2 | |
| SCHEMBL14150812 | 0.95 | NCEH1 (0.56) | WDR5NCEH1LDHANR4A1NR4A2 | |
| SCHEMBL9794886 | 0.87 | NCEH1 (0.50) | NCEH1CNR1CNR2CYP2C9KDM4E | |
| SCHEMBL4948479 | 0.85 | NCEH1 (0.49) | NCEH1CNR1CNR2CYP2C9KDM4E | |
| SCHEMBL18917578 | 0.85 | WDR5 (0.51) | WDR5LDHANR4A1NR4A2NR4A3 | |
| SCHEMBL9321644 | 0.85 | WDR5 (0.51) | WDR5LDHANR4A1NR4A2NR4A3 | |
| SCHEMBL18917570 | 0.85 | WDR5 (0.51) | WDR5LDHANR4A1NR4A2NR4A3 | |
| SCHEMBL21569594 | 0.83 | NCEH1 (0.56) | WDR5NCEH1CNR1CNR2CYP2C9 | |
| SCHEMBL4170309 | 0.82 | WDR5 (0.59) | WDR5NCEH1LDHANR4A1NR4A2 | |
| SCHEMBL29009407 | 0.82 | NCEH1 (0.54) | WDR5NCEH1CNR1CNR2CYP2C9 |
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-4486445-A | OBTAINED FROM JUSTICIA EXTENSA | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1984-12-04 | — | — | US | disclosed |