Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 2/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.38 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 4/20 | 0.36 |
| ▸ | PPARD | Q03181 | 4/20 | 0.36 |
| ▸ | PPARA | Q07869 | 4/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Isophthalic Acid SCHEMBL28068086 | 0.99 | AKR1C3 (0.39) | AKR1C3PDE4APDE4BPDE4CPDE4D | |
| Isophthalic Acid SCHEMBL28068093 | 0.88 | LMNA (0.39) | AKR1C3PPARGPPARDPPARALMNA | |
| Isophthalic Acid SCHEMBL28068084 | 0.84 | HTR6 (0.45) | PTGS2MAPTHTR6 | |
| Isophthalic Acid SCHEMBL28068139 | 0.83 | KMO (0.42) | MAPTHTR6 | |
| Isophthalic Acid SCHEMBL28068057 | 0.82 | NAMPT (0.37) | TBXAS1PPARGPPARDPPARALMNA | |
| Isophthalic Acid SCHEMBL28068050 | 0.82 | KMO (0.41) | MAPTHTR6 | |
| SCHEMBL17971576 | 0.78 | PDE4A (0.42) | PDE4APDE4BPDE4CPDE4DHTR6 | |
| Hydrochloric Acid SCHEMBL16618987 | 0.78 | PDE4A (0.41) | PDE4APDE4BPDE4CPDE4DHTR6 | |
| Isophthalic Acid SCHEMBL28068081 | 0.77 | CKS1B (0.38) | PTGS2LMNAHTR6 | |
| Isophthalic Acid SCHEMBL28068046 | 0.76 | MAPT (0.39) | AKR1C3PPARGCA2CA9LMNA |
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-105612150-A | Sulfonylindole derivatives and process for producing the same | DAE WOONG PHARMA | 2016-05-25 | — | — | CN | disclosed |