Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.65 |
| ▸ | DRD3 | P35462 | 1/20 | 0.65 |
| ▸ | LMNA | P02545 | 4/20 | 0.62 |
| ▸ | MEN1 | O00255 | 3/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.60 |
| ▸ | HPGD | P15428 | 5/20 | 0.60 |
| ▸ | NPC1 | O15118 | 1/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | RAD52 | P43351 | 1/20 | 0.52 |
| ▸ | BRD4 | O60885 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | TOP2A | P11388 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL10925789 | 0.89 | ALDH1A1 (0.70) | ALDH1A1DRD3LMNAMEN1KMT2A | |
| SCHEMBL11394177 | 0.82 | ALDH1A1 (0.76) | ALDH1A1DRD3LMNAMEN1KMT2A | |
| SCHEMBL11071273 | 0.81 | ALDH1A1 (0.70) | ALDH1A1DRD3LMNAMEN1KMT2A | |
| SCHEMBL10923356 | 0.81 | ALDH1A1 (0.72) | ALDH1A1DRD3LMNAMEN1KMT2A | |
| SCHEMBL5960540 | 0.80 | ALDH1A1 (0.69) | ALDH1A1DRD3LMNAMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL11023748 | 0.80 | ALDH1A1 (0.69) | ALDH1A1DRD3LMNAMEN1KMT2A | |
| SCHEMBL5960539 | 0.80 | ALDH1A1 (0.69) | ALDH1A1DRD3LMNAMEN1KMT2A | |
| SCHEMBL9163650 | 0.79 | ALDH1A1 (0.38) | ALDH1A1DRD3LMNAMEN1KMT2A | |
| SCHEMBL9686875 | 0.79 | ALDH1A1 (0.73) | ALDH1A1DRD3LMNAMEN1KMT2A | |
| SCHEMBL7809357 | 0.79 | ALDH1A1 (1.00) | ALDH1A1DRD3LMNAMEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4499091-A | 1-Amino (or substituted amino)-1,4-dihydro-4-oxo-6-fluoro-7-heterylquinoline-3-carboxylic acids and their use as antibacterial agents | STERLING DRUG INC. (US) | 1985-02-12 | — | — | US | claimed |
| EP-0090424-B1 | NEW QUINOLONE COMPOUNDS AND PREPARATION THEREOF | STERLING DRUG INC. (US) | 1986-05-28 | — | — | EP | disclosed |
| US-4499091-A | 1-Amino (or substituted amino)-1,4-dihydro-4-oxo-6-fluoro-7-heterylquinoline-3-carboxylic acids and their use as antibacterial agents | STERLING DRUG INC. (US) | 1985-02-12 | — | — | US | disclosed |