Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 18/20 | 1.00 |
| ▸ | CA1 | P00915 | 15/20 | 1.00 |
| ▸ | CA9 | Q16790 | 14/20 | 1.00 |
| ▸ | CA12 | O43570 | 13/20 | 1.00 |
| ▸ | CA6 | P23280 | 4/20 | 1.00 |
| ▸ | CA5A | P35218 | 4/20 | 1.00 |
| ▸ | CA7 | P43166 | 4/20 | 1.00 |
| ▸ | CA5B | Q9Y2D0 | 4/20 | 1.00 |
| ▸ | CA4 | P22748 | 3/20 | 1.00 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 1.00 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | AGO2 | Q9UKV8 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| Hydrazine SCHEMBL7570110 | 0.98 | CA2 (0.95) | CA2CA1CA9CA12CA6 | |
| Hydrochloric Acid SCHEMBL6696969 | 0.98 | CA2 (0.95) | CA2CA1CA9CA12CA6 | |
| Hydrochloric Acid SCHEMBL981171 | 0.98 | CA2 (0.95) | CA2CA1CA9CA12CA6 | |
| Hydrochloric Acid SCHEMBL27493662 | 0.95 | CA2 (0.91) | CA2CA1CA9CA12CA6 | |
| Hypochlorous Acid SCHEMBL5859040 | 0.93 | CA2 (0.87) | CA2CA1CA9CA12CA6 | |
| SCHEMBL4640918 | 0.82 | ALDH1A1 (0.79) | CA2CA1CA9CA12CA6 | |
| SCHEMBL28102126 | 0.82 | CA2 (0.70) | CA2CA1CA9CA12CA6 | |
| SCHEMBL28107398 | 0.82 | SOS1 (0.70) | CA2CA1CA9CA12CA6 | |
| SCHEMBL22001051 | 0.81 | CA2 (0.68) | CA2CA1CA9CA12CA6 | |
| SCHEMBL202948 | 0.81 | CA2 (0.81) | CA2CA1CA9CA12CA6 |
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 358 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114478493-B | Traceable 5-aminosalicylic acid derivative and preparation and application thereof | 中国科学院兰州化学物理研究所 | 2024-04-02 | — | — | CN | claimed |
| CN-115784947-A | COX-II enzyme inhibitor celecoxib intermediate and synthesis method thereof | 药大制药有限公司 | 2023-03-14 | — | — | CN | claimed |
| CN-110526868-B | Preparation method of celecoxib | 迪嘉药业集团有限公司 | 2022-03-18 | — | — | CN | claimed |
| CN-112986410-A | Method for detecting arylamine and aromatic hydrazine gene toxic impurities in celecoxib | 南京亿华药业有限公司 | 2021-06-18 | — | — | CN | claimed |
| CN-111423375-A | Preparation method of COX-2 specific cyclooxygenase inhibitor | 云南大学 | 2020-07-17 | — | — | CN | claimed |
| CN-111217753-A | Preparation method of celecoxib | 农永强 | 2020-06-02 | — | — | CN | claimed |
| CN-110698404-A | Preparation method of high-purity celecoxib | 安徽恒星制药有限公司 | 2020-01-17 | — | — | CN | claimed |
| CN-110526868-A | A kind of preparation method of celecoxib | WEIHAI DISU PHARMACEUTICAL CO LTD | 2019-12-03 | — | — | CN | claimed |
| CN-109689627-A | Pyrazolyl quinoline compound and preparation method thereof and medical component | 高雄医学大学 | 2019-04-26 | — | — | CN | claimed |
| CN-106480439-A | A kind of chemical nickel plating palldium alloy crosses liquid and its application | 江苏澳光电子有限公司 | 2017-03-08 | — | — | CN | claimed |
| EP-1191931-A4 | 1-(4-SULFAMYLARYL)-3-SUBSTITUTED-5-ARYL-2-PYRAZOLINES AS INHIBITORS OF CYCLOOXYGENASE-2 | UNIV TEMPLE (US) | 2002-11-27 | — | — | EP | claimed |
| EP-0828717-B1 | METHOD OF PREPARING 3-HALOALKYL-1H-PYRAZOLES | SEARLE & CO (US) | 2002-09-04 | — | — | EP | claimed |
| US-6376519-B1 | ANTIINFLAMMATORY AGENTS, ANTICANCER AGENTS | TEMPLE UNIVERSITY-OF THE COMMONWEALTH OF HIGHER EDUCATION | 2002-04-23 | — | — | US | claimed |
| EP-1191931-A1 | 1-(4-SULFAMYLARYL)-3-SUBSTITUTED-5-ARYL-2-PYRAZOLINES AS INHIBITORS OF CYCLOOXYGENASE-2 | Temple University of the Commonwealth System of Higher Education (US) | 2002-04-03 | — | — | EP | claimed |
| WO-2000076503-A1 | 1-(4-SULFAMYLARYL)-3-SUBSTITUTED-5-ARYL-2-PYRAZOLINES AS INHIBITORS OF CYCLOOXYGENASE-2 | TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2000-12-21 | — | — | WO | claimed |
| US-5910597-A | Process for preparing 3-haloalkyl-1H-pyrazoles | G.D. SEARLE & CO. (US) | 1999-06-08 | — | — | US | claimed |
| US-5892053-A | Process for preparing 3-haloalkyl-1H-pyrazoles | G. D. SEARLE & CO. (US) | 1999-04-06 | — | — | US | claimed |
| CN-1190960-A | Method of preparing 3-haloalkyl-1H-pyrazoles | SEARLE & CO (US) | 1998-08-19 | — | — | CN | claimed |
| EP-0828717-A1 | METHOD OF PREPARING 3-HALOALKYL-1H-PYRAZOLES | G.D. SEARLE & CO. (US) | 1998-03-18 | — | — | EP | claimed |
| WO-1996037476-A1 | METHOD OF PREPARING 3-HALOALKYL-1H-PYRAZOLES | G.D. SEARLE & CO. (US) | 1996-11-28 | — | — | WO | claimed |