Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CXCL8 | P10145 | 5/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.41 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.39 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.38 |
| ▸ | UGT1A9 | O60656 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.38 |
| ▸ | TTR | P02766 | 1/20 | 0.38 |
| ▸ | ALB | P02768 | 1/20 | 0.38 |
| ▸ | UGT1A6 | P19224 | 1/20 | 0.38 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.38 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2554055 | 0.85 | AKR1B1 (0.55) | AKR1B1TDP1CXCL8PTGS2BCAT2 | |
| Hydrochloric Acid SCHEMBL10582878 | 0.83 | AKR1B1 (0.53) | AKR1B1TDP1CXCL8PTGS2BCAT2 | |
| SCHEMBL11669660 | 0.81 | AKR1B1 (0.52) | AKR1B1TDP1CXCL8PTGS2BCAT2 | |
| SCHEMBL396915 | 0.80 | AKR1B1 (0.50) | AKR1B1TDP1CXCL8PTGS2BCAT2 | |
| SCHEMBL8086649 | 0.80 | TSHR (0.53) | AKR1B1TDP1CXCL8PTGS2BCAT2 | |
| SCHEMBL6478884 | 0.80 | AKR1B1 (0.46) | AKR1B1TDP1CXCL8PTGS2BCAT2 | |
| SCHEMBL3383898 | 0.79 | AKR1B1 (0.57) | AKR1B1TDP1CXCL8PTGS2BCAT2 | |
| SCHEMBL10680761 | 0.78 | AKR1B1 (0.44) | AKR1B1TDP1CXCL8PTGS2BCAT2 | |
| SCHEMBL19960628 | 0.78 | PKM (0.48) | — | |
| SCHEMBL27717880 | 0.78 | GABRA1 (0.44) | MAPT |
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-7960305-B2 | a mixture of a phosphazenium compound such as tetrakis[tris(dimethylamino)phosphoranylideneamino]phosphonium chloride, transition metal halides and an organic halogen compound as an activator, used for addition homo/copolymerization; living polymers | MITSUI CHEMICALS, INC. (JP) | 2011-06-14 | — | — | US | disclosed |
| US-20080177014-A1 | Polymerization Catalyst Composition and Process for Production of Polymer | MITSUI CHEMICALS, INC. (JP) | 2008-07-24 | — | — | US | disclosed |