Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.36 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.36 |
| ▸ | FEN1 | P39748 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA4 | P22748 | 2/20 | 0.35 |
| ▸ | DPP4 | P27487 | 6/20 | 0.34 |
| ▸ | MMP2 | P08253 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30529258 | 1.00 | HDAC1 (0.39) | HDAC1HDAC8ALDH1A1CYP3A4CYP1A2 | |
| SCHEMBL332576 | 0.82 | CXCL8 (0.43) | HDAC1HDAC8MEN1KMT2ADPP4 | |
| SCHEMBL29362137 | 0.82 | CXCL8 (0.43) | HDAC1HDAC8MEN1KMT2ADPP4 | |
| SCHEMBL29140954 | 0.80 | CXCL8 (0.42) | HDAC1HDAC8MEN1KMT2ADPP4 | |
| SCHEMBL30734413 | 0.80 | CXCL8 (0.42) | HDAC1HDAC8MEN1KMT2ADPP4 | |
| SCHEMBL11035311 | 0.79 | CA1 (0.38) | ALDH1A1CYP3A4CYP1A2CYP2C19KDM4E | |
| Hydrochloric Acid SCHEMBL27770183 | 0.79 | HDAC1 (0.37) | HDAC1HDAC8CA1CA2CA4 | |
| Lithium Ion SCHEMBL31634833 | 0.78 | CA1 (0.40) | HDAC1HDAC8CA1CA2CA4 | |
| SCHEMBL17675533 | 0.78 | MAPK8 (0.44) | ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL29726367 | 0.78 | MAPK8 (0.44) | ALDH1A1KDM4ESMN1; SMN2 |
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-1313708-A1 | QUINOLINE ANTIBACTERIAL COMPOUNDS AND METHODS OF USE THEREOF | CHIRON CORPORATION (US) | 2003-05-28 | — | — | EP | disclosed |
| WO-2002018345-A1 | QUINOLINE ANTIBACTERIAL COMPOUNDS AND METHODS OF USE THEREOF | CHIRON CORPORATION (US) | 2002-03-07 | — | — | WO | disclosed |