Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRAS | P01112 | 13/20 | 0.48 |
| ▸ | ESR1 | P03372 | 13/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 13/20 | 0.48 |
| ▸ | TOP1 | P11387 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | ITGB3 | P05106 | 3/20 | 0.39 |
| ▸ | ITGA2B | P08514 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | TERT | O14746 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5889504 | 0.95 | HRAS (0.52) | HRASESR1ESR2TOP1KDM4E | |
| SCHEMBL5896854 | 0.92 | HRAS (0.48) | HRASESR1ESR2TOP1KDM4E | |
| SCHEMBL5889463 | 0.86 | HRAS (0.46) | HRASESR1ESR2TOP1KDM4E | |
| SCHEMBL5680577 | 0.86 | HRAS (0.44) | HRASESR1ESR2TOP1KDM4E | |
| SCHEMBL5889617 | 0.85 | HRAS (0.50) | HRASESR1ESR2TOP1KDM4E | |
| SCHEMBL7177291 | 0.85 | HRAS (0.39) | HRASESR1ESR2TOP1KDM4E | |
| SCHEMBL5896846 | 0.84 | TOP1 (0.45) | HRASESR1ESR2TOP1KDM4E | |
| SCHEMBL5889611 | 0.82 | HRAS (0.49) | HRASESR1ESR2TOP1KDM4E | |
| SCHEMBL5889829 | 0.80 | HRAS (0.48) | HRASESR1ESR2TOP1KDM4E | |
| SCHEMBL5889570 | 0.76 | MAP3K5 (0.38) | HRASESR1ESR2TOP1KDM4E |
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-7141680-B2 | Aromatic compounds possessing antifungal or antibacterial activity | GENELABS TECHNOLOGIES, INC. | 2006-11-28 | — | — | US | disclosed |