Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | CASP1 | P29466 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 3/20 | 0.36 |
| ▸ | CA2 | P00918 | 3/20 | 0.36 |
| ▸ | CA7 | P43166 | 3/20 | 0.36 |
| ▸ | CA9 | Q16790 | 3/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.36 |
| ▸ | EGFR | P00533 | 2/20 | 0.36 |
| ▸ | MIF | P14174 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ALDH2 | P05091 | 2/20 | 0.33 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9757008 | 0.72 | BRD4 (0.33) | KDM4EALDH1A1HSD17B10KMT2A | |
| SCHEMBL10638905 | 0.71 | PPARG (0.49) | GAAKDM4EALDH1A1HPGDCASP1 | |
| SCHEMBL9635631 | 0.71 | KDM4E (0.54) | GAAKDM4EALDH1A1HPGDCASP1 | |
| SCHEMBL10636272 | 0.69 | AKT1 (0.58) | GAAKDM4EALDH1A1HPGDCASP1 | |
| SCHEMBL10638891 | 0.68 | KDM4E (0.35) | GAAKDM4EALDH1A1HPGDCASP1 | |
| SCHEMBL10639092 | 0.68 | AKT1 (0.60) | GAAKDM4EALDH1A1HPGDCASP1 | |
| SCHEMBL10638595 | 0.68 | KDM4E (0.39) | GAAKDM4EALDH1A1HPGDCASP1 | |
| SCHEMBL11108212 | 0.68 | ALDH1A1 (0.43) | GAAKDM4EALDH1A1HPGDCASP1 | |
| SCHEMBL11112548 | 0.68 | KMT2A (0.43) | GAAKDM4EALDH1A1HPGDCASP1 | |
| SCHEMBL9421327 | 0.66 | POLB (0.47) | GAAKDM4EALDH1A1HPGDHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991019475-A2 | QUINOLINYL-BENZOHETEROBICYCLIC DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D¿4? | RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) | 1991-12-26 | — | — | WO | disclosed |
| US-5041453-A | Quinolinyl-benzoheterobicyclic derivatives as antagonists of leukotriene D4 | RHONE-POULENC RORER PHARMACEUTICALS INC. (US) | 1991-08-20 | — | — | US | disclosed |