Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 6/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.31 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.31 |
| ▸ | TOP2A | P11388 | 2/20 | 0.31 |
| ▸ | TOP2B | Q02880 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | ATP6V1B2 | P21281 | 1/20 | 0.31 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.31 |
| ▸ | EDNRA | P25101 | 1/20 | 0.31 |
| ▸ | TARBP2 | Q15633 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9234525 | 1.00 | DPP4 (0.35) | DPP4KEAP1NFE2L2CHRM2DRD1 | |
| SCHEMBL9283678 | 0.87 | DPP4 (0.34) | DPP4 | |
| SCHEMBL4774919 | 0.87 | DPP4 (0.44) | DPP4CHRM2DRD1CYP2C9ALDH1A1 | |
| SCHEMBL501153 | 0.85 | DPP4 (0.47) | DPP4KEAP1NFE2L2CHRM2DRD1 | |
| SCHEMBL9097293 | 0.85 | DPP4 (0.47) | DPP4KEAP1NFE2L2CHRM2DRD1 | |
| SCHEMBL9014149 | 0.85 | DPP4 (0.47) | DPP4KEAP1NFE2L2CHRM2DRD1 | |
| SCHEMBL7501881 | 0.79 | KDM4E (0.36) | CYP2C9KMT2AALDH1A1TOP2ATOP2B | |
| SCHEMBL6660578 | 0.79 | KDM4E (0.36) | CYP2C9KMT2AALDH1A1TOP2ATOP2B | |
| SCHEMBL9234576 | 0.79 | KDM4E (0.36) | CYP2C9KMT2AALDH1A1TOP2ATOP2B | |
| SCHEMBL13483607 | 0.79 | KMT2A (0.43) | KMT2AALDH1A1POLBLMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0653425-A1 | 1-(2-Fluorocyclopropyl)-quinolone- and naphthyridone carboxylic acid derivatives, their preparation and their use as antibacterials | BAYER AG (DE) | 1995-05-17 | — | — | EP | disclosed |