Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.72 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.61 |
| ▸ | CXCR1 | P25024 | 3/20 | 0.61 |
| ▸ | CXCR2 | P25025 | 3/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.61 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.61 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.61 |
| ▸ | ALB | P02768 | 1/20 | 0.61 |
| ▸ | ESR1 | P03372 | 1/20 | 0.61 |
| ▸ | RARB | P10826 | 1/20 | 0.61 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.61 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.61 |
| ▸ | HTR2A | P28223 | 1/20 | 0.61 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.61 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.61 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.61 |
| ▸ | BLM | P54132 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL12964037 | 0.88 | PTGS2 (0.57) | PTGS2PTGS1CXCR1CXCR2LMNA | |
| SCHEMBL11678768 | 0.87 | PTGS2 (0.75) | PTGS2PTGS1CXCR1CXCR2LMNA | |
| SCHEMBL1046956 | 0.84 | L3MBTL1 (0.61) | PTGS2PTGS1LMNA | |
| SCHEMBL10029026 | 0.84 | L3MBTL1 (0.61) | PTGS2PTGS1LMNA | |
| SCHEMBL2884860 | 0.83 | PTGS2 (0.70) | PTGS2PTGS1CXCR1CXCR2LMNA | |
| SCHEMBL29179760 | 0.83 | PTGS2 (0.70) | PTGS2PTGS1CXCR1CXCR2LMNA | |
| SCHEMBL28110314 | 0.83 | PTGS2 (0.52) | PTGS2PTGS1CXCR1CXCR2LMNA | |
| Iodide SCHEMBL28946796 | 0.82 | L3MBTL1 (0.59) | PTGS2PTGS1CXCR1CXCR2LMNA | |
| SCHEMBL5833971 | 0.82 | PTGS2 (0.54) | PTGS2PTGS1CXCR1CXCR2LMNA | |
| SCHEMBL11228059 | 0.82 | PTGS2 (0.76) | PTGS2PTGS1CXCR1CXCR2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-10400224-B2 | Enantioselective modified esterase enzyme and method for the production thereof | CORPORACIÓN CORPOGEN (CO) | 2019-09-03 | — | — | US | disclosed |
| US-20170130213-A1 | ENANTIOSELECTIVE MODIFIED ESTERASE ENZYME AND METHOD FOR THE PRODUCTION THEREOF | CORPORACIÓN CORPOGEN (CO) | 2017-05-11 | — | — | US | disclosed |
| EP-1509216-B1 | ACTIVE INGREDIENT SALTS AND ESTERS OF 1-DIMETHYLAMINO-3-(3-METHOXY-PHENYL)-2-METHYL-PENTAN-3-OL AND 3-(3-DIMETHYLAMINO-1-ETHYL-1-HYDROXY-2-METHYL-PROPYL)-PHENOL | GRUENENTHAL GMBH (DE) | 2008-05-07 | — | — | EP | disclosed |