Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.41 |
| ▸ | PDE2A | O00408 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RXRA | P19793 | 1/20 | 0.34 |
| ▸ | RXRB | P28702 | 1/20 | 0.34 |
| ▸ | RXRG | P48443 | 1/20 | 0.34 |
| ▸ | POLQ | O75417 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | ESRRA | P11474 | 1/20 | 0.32 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | PIM1 | P11309 | 1/20 | 0.31 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.31 |
| ▸ | PPARA | Q07869 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18299918 | 0.87 | CYP1A1 (0.38) | CES2PDE2AALDH1A1KDM4EHPGD | |
| SCHEMBL18299914 | 0.87 | CYP1A1 (0.38) | CES2PDE2AALDH1A1KDM4EHPGD | |
| SCHEMBL18299915 | 0.87 | CYP1A1 (0.38) | CES2PDE2AALDH1A1KDM4EHPGD | |
| SCHEMBL23148082 | 0.86 | PDE2A (0.36) | CES2PDE2ALMNAMAPTALDH1A1 | |
| SCHEMBL23147718 | 0.86 | HCAR1 (0.32) | HCAR1 | |
| SCHEMBL28169364 | 0.83 | NPSR1 (0.41) | CES2PDE2AMAPTPOLQALDH1A1 | |
| SCHEMBL28169406 | 0.77 | POLQ (0.40) | CES2PDE2ARXRARXRBRXRG | |
| SCHEMBL19332289 | 0.75 | CTSS (0.38) | MAPT | |
| SCHEMBL30262303 | 0.72 | NPSR1 (0.40) | PDE2ALMNAMAPTALDH1A1KDM4E | |
| SCHEMBL18307352 | 0.72 | NPSR1 (0.40) | PDE2ALMNAMAPTALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-107098846-B | N-acyl sulfonamide FBPase inhibitor, preparation method thereof, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2020-10-09 | — | — | CN | disclosed |