Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | TOP1 | P11387 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | TOP2A | P11388 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9145305 | 1.00 | ALDH1A1 (0.45) | ALDH1A1TOP1KDM4EDRD3HSD17B10 | |
| SCHEMBL9147313 | 1.00 | ALDH1A1 (0.45) | ALDH1A1TOP1KDM4EDRD3HSD17B10 | |
| SCHEMBL9145367 | 0.86 | TOP1 (0.44) | ALDH1A1TOP1KDM4EDRD3HSD17B10 | |
| SCHEMBL9145380 | 0.86 | TOP1 (0.44) | ALDH1A1TOP1KDM4EDRD3HSD17B10 | |
| SCHEMBL9145357 | 0.86 | TOP1 (0.44) | ALDH1A1TOP1KDM4EDRD3HSD17B10 | |
| SCHEMBL9147951 | 0.85 | ALDH1A1 (0.64) | ALDH1A1TOP1KDM4EDRD3HSD17B10 | |
| SCHEMBL9147961 | 0.85 | ALDH1A1 (0.64) | ALDH1A1TOP1KDM4EDRD3HSD17B10 | |
| SCHEMBL9147942 | 0.85 | ALDH1A1 (0.64) | ALDH1A1TOP1KDM4EDRD3HSD17B10 | |
| SCHEMBL9142804 | 0.84 | ALDH1A1 (0.62) | ALDH1A1KDM4EHSD17B10LMNAHPGD | |
| SCHEMBL9142836 | 0.84 | ALDH1A1 (0.62) | ALDH1A1KDM4EHSD17B10LMNAHPGD |
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-5393758-A | Bactericides, microbiocides | LABORATORIOS DEL DR. ESTEVE S.A. (ES) | 1995-02-28 | — | — | US | disclosed |