Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 5/20 | 0.54 |
| ▸ | PDE4A | P27815 | 4/20 | 0.54 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.54 |
| ▸ | PDE4C | Q08493 | 4/20 | 0.54 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.52 |
| ▸ | WNT3A | P56704 | 2/20 | 0.52 |
| ▸ | THRA | P10827 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.49 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.48 |
| ▸ | PPARG | P37231 | 1/20 | 0.48 |
| ▸ | PPARA | Q07869 | 1/20 | 0.48 |
| ▸ | HTR7 | P34969 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA4 | P22748 | 1/20 | 0.46 |
| ▸ | CA6 | P23280 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL10729104 | 0.94 | THRA (0.54) | PDE4DPDE4APDE4BPDE4CCTNNB1 | |
| SCHEMBL5325908 | 0.91 | CTNNB1 (0.55) | PDE4DPDE4APDE4BPDE4CCTNNB1 | |
| SCHEMBL29670763 | 0.84 | CTNNB1 (0.67) | PDE4DPDE4APDE4BPDE4CCTNNB1 | |
| SCHEMBL4861157 | 0.84 | CTNNB1 (0.67) | PDE4DPDE4APDE4BPDE4CCTNNB1 | |
| SCHEMBL27872174 | 0.83 | PTPN11 (0.49) | THRATHRBHSD17B3PTPN11 | |
| SCHEMBL17223796 | 0.83 | PTPN11 (0.52) | THRATHRBHSD17B3PTPN11 | |
| SCHEMBL10730928 | 0.82 | GAA (0.54) | PDE4DPDE4APDE4BPDE4CCTNNB1 | |
| SCHEMBL11476787 | 0.81 | GSK3B (0.54) | CTNNB1WNT3ATSHRCA12CA1 | |
| SCHEMBL13959165 | 0.81 | KDM4E (0.57) | THRATHRBHSD17B3PTPN11MEN1 | |
| SCHEMBL7885139 | 0.81 | CFD (0.52) | THRATHRBHSD17B3PTPN11PPARG |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1578757-A2 | FLUOROGENIC ENZYME SUBSTRATES AND METHODS OF PREPARATION | Tibotec BVBA (BE) | 2005-09-28 | — | — | EP | disclosed |
| WO-2004058787-A2 | FLUOROGENIC ENZYME SUBSTRATES AND METHODS OF PREPARATION | TIBOTEC BVBA (BE) | 2004-07-15 | — | — | WO | disclosed |
| CN-1222145-A | Substituted benzamide derivatives and their use as anticonvulsants | SMITHKLINE BEECHAM PLC (GB) | 1999-07-07 | — | — | CN | disclosed |