Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TPMT | P51580 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA3 | P07451 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA6 | P23280 | 1/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | SELL | P14151 | 1/20 | 0.35 |
| ▸ | SELP | P16109 | 1/20 | 0.35 |
| ▸ | SELE | P16581 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27507877 | 0.77 | ALDH1A1 (0.50) | ALDH1A1TPMTTSHRCYP3A4CA1 | |
| SCHEMBL29212116 | 0.77 | ALDH1A1 (0.45) | ALDH1A1TPMTTSHRCYP3A4CYP1A2 | |
| Toluene SCHEMBL28569928 | 0.76 | LMNA (0.55) | ALDH1A1TSHRACHEHPGD | |
| SCHEMBL296587 | 0.73 | — | — | |
| Benzene SCHEMBL28169481 | 0.70 | — | — | |
| Methyl Alcohol SCHEMBL28397318 | 0.69 | ALDH1A1 (0.64) | ALDH1A1TPMTTSHRCYP3A4ACHE | |
| Hydrochloric Acid SCHEMBL28239385 | 0.69 | — | — | |
| SCHEMBL28425258 | 0.69 | ALDH1A1 (0.57) | ALDH1A1TPMTTSHRCYP3A4CA1 | |
| SCHEMBL19376983 | 0.69 | ALDH1A1 (0.57) | ALDH1A1TPMTTSHRCYP3A4CA1 | |
| Methyl Alcohol SCHEMBL27974355 | 0.69 | ALDH1A1 (0.64) | ALDH1A1TPMTTSHRCYP3A4ACHE |
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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112724133-B | Preparation method of 6-bromopyrazolo [1,5-a ] pyridine | 湖南复瑞生物医药技术有限责任公司 | 2022-03-25 | — | — | CN | claimed |
| CN-112724133-A | Preparation method of 6-bromopyrazolo [1,5-a ] pyridine | 湖南复瑞生物医药技术有限责任公司 | 2021-04-30 | — | — | CN | claimed |
| JP-57048966-A | — | — | None | — | — | JP | disclosed |
| CN-113788790-A | Aromatic heterocyclic amide derivative and application thereof | 华东理工大学 | 2021-12-14 | — | — | CN | disclosed |
| CN-106008369-B | The bicyclic dihydropyrimidinonesand being substituted and its purposes as the active inhibitor of Neutrophil elastase | 勃林格殷格翰国际有限公司 | 2019-06-21 | — | — | CN | disclosed |
| CN-106045920-B | The bicyclic dihydropyrimidinonesand being substituted and its purposes as the active inhibitor of Neutrophil elastase | 勃林格殷格翰国际有限公司 | 2018-10-19 | — | — | CN | disclosed |
| CN-106045921-B | The bicyclic dihydropyrimidinonesand being substituted and its purposes as the active inhibitor of Neutrophil elastase | 勃林格殷格翰国际有限公司 | 2018-09-25 | — | — | CN | disclosed |
| CN-105722839-B | Pesticidally active bicyclic heterocycles with sulphur-containing substituents | 先正达参股股份有限公司 | 2018-04-06 | — | — | CN | disclosed |
| CN-104995186-B | Substituted bicyclic dihydropyrimidinones and their use as inhibitors of neutrophil elastase activity | 勃林格殷格翰国际有限公司 | 2017-06-20 | — | — | CN | disclosed |
| CN-103333102-B | Pyridyl-N-cyano sulfo oxime compound and preparation method thereof | BEIJING GREENCHEM TECHNOLOGY CO LTD | 2015-06-17 | — | — | CN | disclosed |
| CN-104447591-A | Energetic compound 3,3'-diamido-2,2'-2(2,2,2-trinitroethyl)-5,5'-linked triazole-diamine and preparation method and intermediate thereof | INST CHEMICAL MATERIAL CHINA ACADEMY ENGINEERING PHYSICS | 2015-03-25 | — | — | CN | disclosed |
| EP-0604920-A1 | Novel cephalosporin compounds | LUCKY LTD. (KR) | 1994-07-06 | — | — | EP | disclosed |
| US-4612311-A | ANXIOLYTIC AGENTS | WARNER-LAMBERT COMPANY (US) | 1986-09-16 | — | — | US | disclosed |
| JP-S5748966-A | PYRIDYLSULFOXYIMINES | WAKO PURE CHEM IND LTD | 1982-03-20 | — | — | JP | disclosed |
| US-4259494-A | ANTIHISTAMINIC, ANTITUSSIVE, ANTIINFLAMMATORY, SEDATIVE, DIURETIC | WARNER-LAMBERT COMPANY (US) | 1981-03-31 | — | — | US | disclosed |
| US-4110448-A | ANTIHISTAMINE, ANTITUSSIVE, ANTIINFLAMMATORY, SEDATIVE, DIURETIC | WARNER-LAMBERT COMPANY (US) | 1978-08-29 | — | — | US | disclosed |
| US-4076723-A | ANTIHISTAMINES, ANTITUSSIVE AGENTS, ANTIINFLAMMATORY AGENTS, SEDATIVES, DIURETICS | WARNER-LAMBERT COMPANY (US) | 1978-02-28 | — | — | US | disclosed |
| US-4033981-A | ANTIHISTOMINIC, ANTIINFLAMMATORY, SEDATIVES, DIURETICS | WARNER-LAMBERT COMPANY (US) | 1977-07-05 | — | — | US | disclosed |
| US-3992376-A | ANTIHISTAMINES, ANTITUSSIVES, SEDATIVES, ANTIINFLAMMATORY AGENTS AND DIURETICS | WARNER-LAMBERT COMPANY (US) | 1976-11-16 | — | — | US | disclosed |
| US-3978052-A | ANTIHISTAMINIC, ANTITUSSIVE, ANTIINFLAMMATORY, DIURETIC | WARNER-LAMBERT COMPANY (US) | 1976-08-31 | — | — | US | disclosed |