Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.43 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.43 |
| ▸ | GRIK3 | Q13003 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 6/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7651686 | 1.00 | CYP1A2 (0.47) | CYP1A2PTGS2GRIK1GRIK2GRIK3 | |
| SCHEMBL7656485 | 0.83 | HSD11B1 (0.47) | CYP1A2GRIK1GRIK2MAOBALDH1A1 | |
| SCHEMBL7656477 | 0.83 | HSD11B1 (0.47) | CYP1A2GRIK1GRIK2MAOBALDH1A1 | |
| SCHEMBL7650815 | 0.83 | RAB9A (0.46) | GRIK1GRIK2MAOBALDH1A1MAPT | |
| SCHEMBL7650821 | 0.83 | RAB9A (0.46) | GRIK1GRIK2MAOBALDH1A1MAPT | |
| SCHEMBL7657357 | 0.82 | PAM (0.53) | CYP1A2MAOBHDAC2HDAC3HDAC4 | |
| SCHEMBL7657362 | 0.82 | PAM (0.53) | CYP1A2MAOBHDAC2HDAC3HDAC4 | |
| SCHEMBL7650810 | 0.80 | GSK3B (0.54) | CYP1A2GRIK1GRIK2HDAC2HDAC3 | |
| SCHEMBL7650816 | 0.80 | GSK3B (0.54) | CYP1A2GRIK1GRIK2HDAC2HDAC3 | |
| SCHEMBL29260522 | 0.78 | PTGS2 (0.55) | CYP1A2PTGS2MAOBALDH1A1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6491903-B1 | NARROW MOLECULAR WEIGHT DISTRIBUTION SHELL-CORE POLYMERS HAVING HYDROPHILIC, CROSSLINKED PERMEABLE SHELLS AND HYDROPHOBIC CORES, USED FOR REDUCING BLOOD CHOLESTEROL AND BILE ACID UPTAKE IN INTERSTINES; DRUG DELIVERY | WASHINGTON UNIVERSITY | 2002-12-10 | — | — | US | disclosed |
| US-6383500-B1 | Particles comprising amphiphilic copolymers, having a crosslinked shell domain and an interior core domain, useful for pharmaceutical and other applications | WASHINGTON UNIVERSITY | 2002-05-07 | — | — | US | disclosed |