Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | HTR2C | P28335 | 2/20 | 0.51 |
| ▸ | RORC | P51449 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.45 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.45 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.45 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.45 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.45 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.45 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12167420 | 1.00 | SMN1; SMN2 (0.52) | SMN1; SMN2NPC1RAB9AHTR2CRORC | |
| SCHEMBL4174274 | 0.87 | SMN1; SMN2 (0.50) | SMN1; SMN2NPC1RAB9AHTR2CRORC | |
| SCHEMBL4181131 | 0.87 | SMN1; SMN2 (0.50) | SMN1; SMN2NPC1RAB9AHTR2CRORC | |
| SCHEMBL4174279 | 0.87 | SMN1; SMN2 (0.50) | SMN1; SMN2NPC1RAB9AHTR2CRORC | |
| SCHEMBL1189044 | 0.86 | SMN1; SMN2 (0.52) | SMN1; SMN2NPC1RAB9AHTR2CRORC | |
| SCHEMBL12492571 | 0.86 | SMN1; SMN2 (0.52) | SMN1; SMN2NPC1RAB9AHTR2CRORC | |
| SCHEMBL12167385 | 0.86 | SMN1; SMN2 (0.49) | SMN1; SMN2NPC1RAB9AHTR2CRORC | |
| SCHEMBL1189001 | 0.85 | SMN1; SMN2 (0.52) | SMN1; SMN2NPC1RAB9AHTR2CRORC | |
| SCHEMBL12683506 | 0.85 | SMN1; SMN2 (0.52) | SMN1; SMN2NPC1RAB9AHTR2CRORC | |
| SCHEMBL15883700 | 0.85 | SMN1; SMN2 (0.53) | SMN1; SMN2NPC1RAB9AHTR2CRORC |
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-7563805-B2 | 7-[3-Amino-3,4-dimethylpyrrolidine-1-yl]-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-1,4-dihydro-8-methyl-4-oxoquinoline-3-carboxylic acid: quinoline bactericide; broad spectrum, strong antibacterial activity for Grampositive/-negative including multiple resistant cocci; side effect reductcion; drug design | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2009-07-21 | — | — | US | disclosed |