Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 6/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 6/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 6/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 6/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | VEGFA | P15692 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | PDE5A | O76074 | 1/20 | 0.33 |
| ▸ | TNF | P01375 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | PDE1A | P54750 | 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 | |
|---|---|---|---|---|
| SCHEMBL11206098 | 1.00 | MAPT (0.38) | MAPTMAP3K14PDE4APDE4BPDE4C | |
| SCHEMBL13977388 | 1.00 | MAPT (0.38) | MAPTMAP3K14PDE4APDE4BPDE4C | |
| SCHEMBL11206101 | 1.00 | MAPT (0.38) | MAPTMAP3K14PDE4APDE4BPDE4C | |
| SCHEMBL20343542 | 0.95 | MAP3K14 (0.34) | MAPTMAP3K14MTNR1APKM | |
| SCHEMBL7217095 | 0.93 | ALDH1A1 (0.40) | MAPTMAP3K14PDE4APDE4BPDE4C | |
| SCHEMBL2380603 | 0.91 | ALDH1A1 (0.38) | MAPTMAP3K14PDE4APDE4BPDE4C | |
| SCHEMBL7794999 | 0.90 | — | — | |
| SCHEMBL7214892 | 0.88 | MAP3K14 (0.36) | MAPTMAP3K14PDE4APDE4BPDE4C | |
| SCHEMBL25175873 | 0.83 | SLC6A1 (0.35) | MAPTMAP3K14LMNAKDM4EKMT2A | |
| SCHEMBL26984265 | 0.82 | — | — |
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-0090362-A2 | Derivatives of cycloalka(c)pyrrole-carboxylic acids, process for their preparation, agents containing them and their use, as well as cycloalka(c)pyrrole-carboxylic acids as intermediates, and process for their preparation | HOECHST AKTIENGESELLSCHAFT (DE) | 1983-10-05 | — | — | EP | disclosed |