Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 11/20 | 0.67 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.67 |
| ▸ | MT-CO2 | P00403 | 3/20 | 0.67 |
| ▸ | CA12 | O43570 | 1/20 | 0.67 |
| ▸ | CA1 | P00915 | 1/20 | 0.67 |
| ▸ | CA2 | P00918 | 1/20 | 0.67 |
| ▸ | LMNA | P02545 | 1/20 | 0.67 |
| ▸ | CA3 | P07451 | 1/20 | 0.67 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.67 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.67 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.67 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.67 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.67 |
| ▸ | CA4 | P22748 | 1/20 | 0.67 |
| ▸ | CA6 | P23280 | 1/20 | 0.67 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.67 |
| ▸ | PDE4A | P27815 | 1/20 | 0.67 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.67 |
| ▸ | CA5A | P35218 | 1/20 | 0.67 |
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 | |
|---|---|---|---|---|
| SCHEMBL8477525 | 0.92 | PTGS2 (0.60) | PTGS2PTGS1MT-CO2CA12CA1 | |
| SCHEMBL8473191 | 0.91 | PTGS2 (0.55) | PTGS2PTGS1MT-CO2CA12CA1 | |
| SCHEMBL8473750 | 0.90 | PTGS2 (0.65) | PTGS2PTGS1MT-CO2CA12CA1 | |
| SCHEMBL8477992 | 0.89 | PTGS2 (0.57) | PTGS2PTGS1MT-CO2CA12CA1 | |
| SCHEMBL8473861 | 0.89 | PTGS2 (0.67) | PTGS2PTGS1MT-CO2CA12CA1 | |
| SCHEMBL8474687 | 0.89 | PTGS2 (0.57) | PTGS2PTGS1MT-CO2CA12CA1 | |
| SCHEMBL8477909 | 0.87 | PTGS2 (0.60) | PTGS2PTGS1MT-CO2CA12CA1 | |
| SCHEMBL8480076 | 0.87 | PTGS2 (0.52) | PTGS2PTGS1MT-CO2CA12CA1 | |
| SCHEMBL8477487 | 0.86 | PTGS2 (0.54) | PTGS2PTGS1MT-CO2CA12CA1 | |
| SCHEMBL8475740 | 0.86 | PTGS2 (0.64) | PTGS2PTGS1MT-CO2CA12CA1 |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110041282-B | Parecoxib sodium related substance, preparation method and application thereof | 正大天晴药业集团股份有限公司 | 2022-05-20 | — | — | CN | claimed |
| US-5859257-A | ANTIINFLAMMATORY, ANTIARTHRITIC AGENTS | G. D. SEARLE & CO. (US) | 1999-01-12 | — | — | US | claimed |
| US-5700816-A | ANTIARTHRITIC AGENTS | G.D. SEARLE & CO. | 1997-12-23 | — | — | US | claimed |
| CN-110041282-B | Parecoxib sodium related substance, preparation method and application thereof | 正大天晴药业集团股份有限公司 | 2022-05-20 | — | — | CN | disclosed |
| CN-110041282-B | Parecoxib sodium related substance, preparation method and application thereof | 正大天晴药业集团股份有限公司 | 2022-05-20 | — | — | CN | disclosed |
| CN-111153865-A | Parecoxib sodium substituted impurity and preparation method thereof | 上海臣邦医药科技股份有限公司 | 2020-05-15 | — | — | CN | disclosed |
| WO-2005020895-A2 | METHOD FOR THE TREATMENT OR PREVENTION OF BONE DISORDERS WITH A CYCLOOXYGENASE-2 INHIBITOR ALONE AND IN COMBINATION WITH A BONE DISORDER TREATMENT AGENT AND COMPOSITIONS THEREWITH | PHARMACIA CORPORATION (US) | 2005-03-10 | — | — | WO | disclosed |
| US-6649629-B2 | 4-(5-(4-chlorophenyl)-3-((nitrooxy)methyl)-3-hydropyrazolyl) -benzenesulfonamide, for example; treating gastrointestinal disorders, ulcer healing agents, treating disorders resulting from elevated cyclooxygenase (COX-2) | NITROMED, INC. | 2003-11-18 | — | — | US | disclosed |
| US-5932598-A | NOVEL SUBSTITUTED SULFONAMIDE COMPOUNDS USEFUL AS PRODRUGS; ADMINISTERING TO TREAT INFLAMMATION-ASSOCIATED PAIN DUE TO CANCER, DENTAL PAIN; CYCLOOXYGENASE-2 INHIBITORS | G. D. SEARLE & CO. (US) | 1999-08-03 | — | — | US | disclosed |
| US-5859257-A | ANTIINFLAMMATORY, ANTIARTHRITIC AGENTS | G. D. SEARLE & CO. (US) | 1999-01-12 | — | — | US | disclosed |
| US-5700816-A | ANTIARTHRITIC AGENTS | G.D. SEARLE & CO. | 1997-12-23 | — | — | US | disclosed |