Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9416381 | 1.00 | CYP3A4 (0.39) | CYP3A4ALDH1A1POLBCHRM2CHRM1 | |
| SCHEMBL9416398 | 1.00 | CYP3A4 (0.39) | CYP3A4ALDH1A1POLBCHRM2CHRM1 | |
| SCHEMBL9416454 | 0.88 | CYP3A4 (0.38) | CYP3A4CNR1CNR2 | |
| SCHEMBL9416459 | 0.88 | CYP3A4 (0.38) | CYP3A4CNR1CNR2 | |
| SCHEMBL8733429 | 0.86 | ALDH1A1 (0.43) | ALDH1A1POLBCHRM2CHRM1OPRM1 | |
| SCHEMBL9044990 | 0.85 | ALDH1A1 (0.39) | CYP3A4ALDH1A1POLBCHRM2CHRM1 | |
| SCHEMBL5277397 | 0.85 | ALDH1A1 (0.39) | CYP3A4ALDH1A1POLBCHRM2CHRM1 | |
| SCHEMBL5278404 | 0.85 | ALDH1A1 (0.39) | CYP3A4ALDH1A1POLBCHRM2CHRM1 | |
| SCHEMBL9238604 | 0.85 | ALDH1A1 (0.39) | CYP3A4ALDH1A1POLBCHRM2CHRM1 | |
| SCHEMBL9147833 | 0.85 | CYP3A4 (0.48) | CYP3A4ALDH1A1POLBCHRM2CHRM1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0607825-A1 | 6-H-4-OXO-3-quinoline-carboxylic acids and their analogues as antibacterial agents | BAYER AG (DE) | 1994-07-27 | — | — | EP | claimed |
| EP-0607825-A1 | 6-H-4-OXO-3-quinoline-carboxylic acids and their analogues as antibacterial agents | BAYER AG (DE) | 1994-07-27 | — | — | EP | disclosed |