Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 3/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 5/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 5/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 3/20 | 0.44 |
| ▸ | HTR2C | P28335 | 3/20 | 0.44 |
| ▸ | HTR2B | P41595 | 3/20 | 0.44 |
| ▸ | DRD2 | P14416 | 2/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10367449 | 0.91 | OPRM1 (0.47) | OPRM1SIGMAR1CHRM2CHRM3KCNH2 | |
| SCHEMBL1307812 | 0.90 | OPRM1 (0.55) | OPRM1SIGMAR1CHRM2CHRM3KCNH2 | |
| SCHEMBL10901330 | 0.84 | KMT2A (0.47) | OPRM1DRD2CHRM4MEN1KMT2A | |
| SCHEMBL10901335 | 0.83 | OPRM1 (0.40) | OPRM1SIGMAR1CHRM2CHRM3KCNH2 | |
| SCHEMBL20544083 | 0.83 | KDM4E (0.55) | OPRM1CHRM2CHRM3MEN1KMT2A | |
| SCHEMBL20544081 | 0.83 | KDM4E (0.55) | OPRM1CHRM2CHRM3MEN1KMT2A | |
| SCHEMBL1306000 | 0.83 | OPRM1 (0.61) | OPRM1SIGMAR1CHRM2CHRM3KCNH2 | |
| SCHEMBL5171694 | 0.78 | OPRM1 (0.57) | OPRM1SIGMAR1CHRM3KCNH2DRD2 | |
| SCHEMBL1062230 | 0.78 | OPRM1 (0.56) | OPRM1SIGMAR1CHRM2CHRM3KCNH2 | |
| SCHEMBL1207106 | 0.77 | OPRM1 (0.54) | OPRM1SIGMAR1CHRM2CHRM3KCNH2 |
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-0172651-B1 | Substituted-9-fluoro-3-methyl-7-oxo-2,3-dihydro-7H-pyrido[1,2,3-de][1,4]benzoxazine-6-carboxylic acids; substituted-5-amino-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acids; substituted-5-amino-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic acids; derivatives thereof; pharmaceutical compositions comprising the compounds; and processes for producing the compounds | WARNER-LAMBERT COMPANY (US) | 1990-02-07 | — | — | EP | disclosed |