Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA4 | P22748 | 1/20 | 0.45 |
| ▸ | CA6 | P23280 | 1/20 | 0.45 |
| ▸ | CA5A | P35218 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.45 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.43 |
| ▸ | CYP4F2 | P78329 | 4/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5992941 | 0.91 | TDP1 (0.62) | CA2TDP1TSHRCA1CA12 | |
| SCHEMBL195127 | 0.87 | CA2 (0.45) | CA2TDP1TSHRCA1CA12 | |
| SCHEMBL9315246 | 0.84 | CA2 (0.56) | CA2TDP1TSHRCA1CA12 | |
| SCHEMBL40656 | 0.83 | CA2 (0.77) | CA2TDP1TSHRCA1CA12 | |
| SCHEMBL15368855 | 0.81 | TDP1 (0.56) | CA2TDP1KDM4EALDH1A1MAPT | |
| SCHEMBL23155118 | 0.80 | CA2 (0.52) | CA2TDP1TSHRCA1CA12 | |
| SCHEMBL1097266 | 0.80 | CA2 (0.52) | CA2TDP1GAACYP4F2CYP4A11 | |
| SCHEMBL6057959 | 0.80 | CA2 (0.72) | CA2TDP1TSHRCA1CA12 | |
| SCHEMBL10887327 | 0.78 | TSHR (0.48) | CA2TSHRCA1CA12CA4 | |
| SCHEMBL1097850 | 0.77 | SLC6A4 (0.50) | CA2TDP1TSHRCA1CA12 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4122258-A | Process for producing desacetoxycephalosporin derivatives by heating a penicillin-1-oxide in presence of an organic sulfide | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1978-10-24 | — | — | US | claimed |
| CN-111393683-B | Modified cationic microgel and preparation method and application thereof | 广东科德环保科技股份有限公司 | 2023-05-23 | — | — | CN | disclosed |
| CN-107849415-B | Adhesive agent | 积水化学工业株式会社 | 2020-11-06 | — | — | CN | disclosed |
| US-8115046-B2 | Micro encapsulation composition for hydrocarbons and detoxification of highly hazardous chemicals and substances | RTA SYSTEMS, INC. (US) | 2012-02-14 | — | — | US | disclosed |
| CN-101516852-B | Quinoline derivatives with 5-ht-binding properties | HOFFMANN LA ROCHE | 2011-11-16 | — | — | CN | disclosed |
| US-20090245939-A1 | DUAL-USE MICRO ENCAPSULATION COMPOSITION FOR HYDROCARBONS AND DETOXIFICATION OF HIGHLY HAZARDOUS CHEMICALS AND SUBSTANCES | RTA SYSTEMS, INC. (US) | 2009-10-01 | — | — | US | disclosed |
| CN-101516852-A | Quinoline derivatives with 5-HT-binding properties | HOFFMANN LA ROCHE (CH) | 2009-08-26 | — | — | CN | disclosed |
| EP-0325187-A1 | 4-alkyl-1, 4-dihydropyridines with PAF-antagonist activity | ALTER, S.A. (ES) | 1989-07-26 | — | — | EP | disclosed |
| US-4122258-A | Process for producing desacetoxycephalosporin derivatives by heating a penicillin-1-oxide in presence of an organic sulfide | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1978-10-24 | — | — | US | disclosed |