Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Diethylamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.39 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Benzylamine SCHEMBL8854676 | 0.83 | LOXL2 (0.67) | SIGMAR1TP53MEN1KMT2ATDP1 | |
| Butane SCHEMBL8374343 | 0.81 | TP53 (0.55) | SIGMAR1TP53TDP1LOXL2TRPA1 | |
| Ethane SCHEMBL27965425 | 0.81 | TP53 (0.53) | SIGMAR1TP53TDP1LOXL2TRPA1 | |
| SCHEMBL3369428 | 0.81 | — | — | |
| Diethylamine SCHEMBL23466778 | 0.80 | MEN1 (0.61) | SIGMAR1TP53MEN1KMT2ATDP1 | |
| (Chloromethyl)Benzene SCHEMBL4820477 | 0.78 | TP53 (0.46) | SIGMAR1TP53MEN1KMT2ATDP1 | |
| SCHEMBL28115920 | 0.78 | — | — | |
| Iodide SCHEMBL27756362 | 0.78 | LOXL2 (0.56) | TP53TDP1LOXL2TRPA1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL28411299 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL27338967 | 0.78 | LOXL2 (0.56) | TP53TDP1LOXL2TRPA1ALDH1A1 |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102603810-A | Rare earth complex and preparation method of rare earth complex, catalysis system for polymerization and preparation method of catalysis system, and preparation method of polymer | CHANGCHUN APPLIED CHEMISTRY | 2012-07-25 | — | — | CN | claimed |
| CN-101693728-B | Rare earth complex chelated by tridentate carbazolyl, preparation method and application in conjugated diene high cis-1, 4 selective polymerization | CHANGCHUN APPLIED CHEMISTRY | 2012-05-23 | — | — | CN | claimed |
| CN-101906187-B | Application of rare earth compound with constrained geometry configuration in high-selectivity conjugated diolefin-styrene random or block copolymerization | CHANGCHUN APPLIED CHEMISTRY | 2012-05-16 | — | — | CN | claimed |
| CN-102762599-A | Polymers functionalized with polyoxime compounds and methods for their manufacture | BRIDGESTONE CORP | 2012-10-31 | — | — | CN | disclosed |
| CN-101563398-B | Branched polymers and methods of synthesis and use thereof | BRIDGESTONE CORP | 2012-10-24 | — | — | CN | disclosed |
| CN-102746542-A | A method for producing functionalized cis-1,4polydienes having high cis-1,4-linkage content and high functionality | BRIDGESTONE CORP | 2012-10-24 | — | — | CN | disclosed |
| CN-102666596-A | Processes for preparation of cyclic acyclic diene copolymer and rubber composition | BRIDGESTONE CORP | 2012-09-12 | — | — | CN | disclosed |
| CN-101704848-B | Rare earth allyl complex with constrained geometry configuration, preparation method thereof and applications thereof in conjugated diene high-cis-1, 4-selective polymerization | CHANGCHUN APPLIED CHEMISTRY | 2012-09-05 | — | — | CN | disclosed |
| CN-102639568-A | Functionalized polymers and methods for their manufacture | BRIDGESTONE CORP | 2012-08-15 | — | — | CN | disclosed |
| CN-102603810-A | Rare earth complex and preparation method of rare earth complex, catalysis system for polymerization and preparation method of catalysis system, and preparation method of polymer | CHANGCHUN APPLIED CHEMISTRY | 2012-07-25 | — | — | CN | disclosed |
| CN-102597026-A | Process and catalyst system for polydiene production | BRIDGESTONE CORP | 2012-07-18 | — | — | CN | disclosed |
| CN-101225134-B | Process for producing functionalized cis-1, 4-polydienes having high cis-1, 4-linkage content and high functionality | BRIDGESTONE CORP | 2012-07-18 | — | — | CN | disclosed |
| CN-102482375-A | PROCESS FOR PRODUCING POLYDIENES | BRIDGESTONE CORP | 2012-05-30 | — | — | CN | disclosed |
| CN-101693728-B | Rare earth complex chelated by tridentate carbazolyl, preparation method and application in conjugated diene high cis-1, 4 selective polymerization | CHANGCHUN APPLIED CHEMISTRY | 2012-05-23 | — | — | CN | disclosed |
| CN-101906187-B | Application of rare earth compound with constrained geometry configuration in high-selectivity conjugated diolefin-styrene random or block copolymerization | CHANGCHUN APPLIED CHEMISTRY | 2012-05-16 | — | — | CN | disclosed |
| CN-102432758-A | Method for preparing styrene-isoprene-butadiene terpolymer | CHANGCHUN APPLIED CHEMISTRY | 2012-05-02 | — | — | CN | disclosed |
| CN-102361887-A | Polymers functionalized with nitrile compounds containing a protected amino group | BRIDGESTONE CORP | 2012-02-22 | — | — | CN | disclosed |
| CN-102361888-A | Polymers functionalized with polycyano compounds | BRIDGESTONE CORP | 2012-02-22 | — | — | CN | disclosed |
| CN-101367825-B | Double-carbene clamp type rareearth complexes, preparation method and uses of the same in cis-1,4 selective polymerization of diolefin | CHANGCHUN INSTITUTE OF APPLIED CHEMISTRY CHINESE ACADEMY OF SCIENCES (CN) | 2012-02-08 | — | — | CN | disclosed |