Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 2/20 | 0.46 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.44 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.40 |
| ▸ | PTGER4 | P35408 | 3/20 | 0.40 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GUCY1B2 | O75343 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | GUCY1A2 | P33402 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1214836 | 0.84 | ELANE (0.64) | ELANEPTGDR2MCL1PLA2G2APTGER4 | |
| SCHEMBL1216862 | 0.82 | CYP1A2 (0.51) | ELANEPTGDR2MCL1PLA2G2APTGER4 | |
| SCHEMBL31482858 | 0.79 | ELANE (0.44) | ELANEMCL1MAPK8KDM4E | |
| SCHEMBL17624218 | 0.77 | HSD11B1 (0.46) | ELANEPTGDR2PTGER4POLBHDAC3 | |
| SCHEMBL14493428 | 0.77 | PTGER4 (0.45) | MCL1PTGER4KDM4EALDH1A1GAA | |
| SCHEMBL17608449 | 0.76 | PTGER4 (0.51) | ELANEPTGDR2MCL1PTGER4CYP1A2 | |
| SCHEMBL21496917 | 0.75 | PTGER4 (0.46) | PTGDR2MCL1PTGER4HDAC3HDAC1 | |
| SCHEMBL17624291 | 0.75 | ELANE (0.53) | ELANEPTGDR2MCL1PLA2G2APTGER4 | |
| SCHEMBL30602797 | 0.75 | CNR2 (0.53) | ELANEPTGDR2KDM4EGUCY1B2CYP1A2 | |
| SCHEMBL24149122 | 0.73 | ELANE (0.56) | ELANEMCL1PTGER4MAPK8HDAC8 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016041618-A1 | SUBSTITUTED INDAZOLES AND RELATED HETEROCYCLES | MERCK PATENT GMBH (DE) | 2016-03-24 | — | — | WO | disclosed |