Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.46 |
| ▸ | TOP2A | P11388 | 8/20 | 0.41 |
| ▸ | TOP2B | Q02880 | 8/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.38 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9147990 | 1.00 | CYP3A4 (0.48) | CYP3A4CHRM1ALDH1A1POLBCHRM2 | |
| SCHEMBL9147833 | 1.00 | CYP3A4 (0.48) | CYP3A4CHRM1ALDH1A1POLBCHRM2 | |
| SCHEMBL2082271 | 0.89 | CYP3A4 (0.47) | CYP3A4CHRM1ALDH1A1POLBCHRM2 | |
| SCHEMBL2082268 | 0.89 | CYP3A4 (0.47) | CYP3A4CHRM1ALDH1A1POLBCHRM2 | |
| SCHEMBL9146697 | 0.88 | CYP3A4 (0.48) | CYP3A4CHRM1ALDH1A1POLBCHRM2 | |
| SCHEMBL9146693 | 0.88 | CYP3A4 (0.48) | CYP3A4CHRM1ALDH1A1POLBCHRM2 | |
| SCHEMBL4747726 | 0.87 | CYP3A4 (0.48) | CYP3A4CHRM1ALDH1A1POLBCHRM2 | |
| SCHEMBL2082061 | 0.85 | CYP3A4 (0.51) | CYP3A4TOP2ATOP2BKDM4ECYP1A2 | |
| SCHEMBL2082062 | 0.85 | CYP3A4 (0.51) | CYP3A4TOP2ATOP2BKDM4ECYP1A2 | |
| SCHEMBL27511886 | 0.85 | CYP3A4 (0.51) | CYP3A4TOP2ATOP2BKDM4ECYP1A2 |
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 4 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 |
| US-5457104-A | Antibacterials | BAYER AKTIENGESELLSCHAFT (DE) | 1995-10-10 | — | — | US | disclosed |
| CN-1097423-A | Quinolone-and naphthyridonecarboxylic acid derivatives | BAYER AG (DE) | 1995-01-18 | — | — | CN | disclosed |
| 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 |