Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | ABCC9 | O60706 | 5/20 | 0.34 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.32 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.32 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 3/20 | 0.32 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.32 |
| ▸ | KCNE1 | P15382 | 3/20 | 0.32 |
| ▸ | KCNQ1 | P51787 | 3/20 | 0.32 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9681489 | 0.88 | ALDH1A1 (0.41) | KDM4EALDH1A1ABCB1MEN1CYP1A2 | |
| SCHEMBL9682813 | 0.86 | PDE4A (0.37) | PDE4APDE4BPDE4CPDE4DABCC9 | |
| SCHEMBL9682898 | 0.84 | RARA (0.32) | KDM4E | |
| SCHEMBL9682129 | 0.81 | ALDH1A1 (0.36) | ALDH1A1MAPK1MALT1MEN1CYP1A2 | |
| SCHEMBL9682834 | 0.76 | PDPK1 (0.39) | PDE4APDE4BPDE4CPDE4DABCC9 | |
| SCHEMBL9525977 | 0.75 | OPRD1 (0.37) | KDM4EPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL8195282 | 0.73 | OPRD1 (0.44) | PDE4APDE4BPDE4CPDE4DABCC9 | |
| SCHEMBL9523959 | 0.73 | PDE4A (0.37) | KDM4EPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL9527583 | 0.73 | PDE4A (0.42) | PDE4APDE4BPDE4CPDE4DABCC9 | |
| SCHEMBL9680897 | 0.72 | ALDH1A1 (0.43) | KDM4EALDH1A1MEN1CYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5112839-A | CHROMAN DERIVATIVES | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1992-05-12 | — | — | US | disclosed |