Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.52 |
| ▸ | RXRA | P19793 | 5/20 | 0.49 |
| ▸ | RXRB | P28702 | 5/20 | 0.49 |
| ▸ | RXRG | P48443 | 4/20 | 0.49 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.46 |
| ▸ | CDH1 | P12830 | 1/20 | 0.44 |
| ▸ | APC | P25054 | 1/20 | 0.44 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.44 |
| ▸ | TCF7L2 | Q9NQB0 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.43 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9953088 | 0.87 | MAPK14 (0.49) | KDM4EL3MBTL1LTB4RRXRARXRB | |
| SCHEMBL18945728 | 0.84 | CDH1 (0.54) | KDM4EGAALTB4RRXRARXRB | |
| SCHEMBL18945588 | 0.84 | CDH1 (0.54) | KDM4EGAALTB4RCDH1APC | |
| SCHEMBL15378448 | 0.82 | CDH1 (0.47) | KDM4EGAALTB4RRXRARXRB | |
| SCHEMBL10212183 | 0.82 | TP53 (0.57) | KDM4ELMNAGAACDH1APC | |
| SCHEMBL15378320 | 0.81 | MAPT (0.49) | KDM4ELMNAGAACDH1APC | |
| SCHEMBL15378450 | 0.81 | ALDH1A1 (0.47) | LTB4RCDH1APCCTNNB1TCF7L2 | |
| SCHEMBL15377642 | 0.81 | NAMPT (0.58) | KDM4ELMNAGAAALDH1A1HPGD | |
| SCHEMBL15377648 | 0.80 | NAMPT (0.47) | KDM4ELMNACDH1APCCTNNB1 | |
| SCHEMBL15378245 | 0.80 | POLB (0.47) | KDM4ELMNAGAACDH1APC |
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-2661428-B1 | QUINOXALINES AND AZA-QUINOXALINES AS CRTH2 RECEPTOR MODULATORS | MERCK SHARP & DOHME (US) | 2017-06-07 | — | — | EP | disclosed |