Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of N-Benzylmethylamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.77 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.77 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.77 |
| ▸ | IDO1 | P14902 | 3/20 | 0.52 |
| ▸ | THRB | P10828 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | ALPL | P05186 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| N-Benzylmethylamine SCHEMBL28925162 | 0.90 | CYP3A4 (0.85) | MAPTCYP3A4KDM4EIDO1THRB | |
| N-Benzylmethylamine SCHEMBL9871758 | 0.90 | MAPT (0.85) | MAPTCYP3A4KDM4EIDO1THRB | |
| N-Benzylmethylamine SCHEMBL11696446 | 0.90 | CYP3A4 (0.94) | MAPTCYP3A4KDM4EIDO1THRB | |
| N-Benzylmethylamine SCHEMBL2271 | 0.90 | — | — | |
| N-Benzylmethylamine SCHEMBL4609847 | 0.90 | CYP3A4 (0.94) | MAPTCYP3A4KDM4EIDO1THRB | |
| SCHEMBL24334039 | 0.90 | CYP3A4 (0.94) | MAPTCYP3A4KDM4EIDO1THRB | |
| N-Benzylmethylamine SCHEMBL837568 | 0.87 | CYP3A4 (0.90) | MAPTCYP3A4KDM4EIDO1THRB | |
| N-Benzylmethylamine SCHEMBL224962 | 0.87 | CYP3A4 (0.90) | MAPTCYP3A4KDM4EIDO1THRB | |
| N-Benzylmethylamine SCHEMBL8083805 | 0.87 | — | — | |
| N-Benzylmethylamine SCHEMBL237384 | 0.87 | MAPT (1.00) | MAPTCYP3A4KDM4EIDO1THRB |
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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108358524-A | A kind of outer wall self heat-preserving brick | 宁波纯恒固废科技有限公司 | 2018-08-03 | — | — | CN | claimed |
| CN-107954857-A | A kind of brufen resolution process and the purification process based on the resolution process | 潍坊新益制药技术有限公司 | 2018-04-24 | — | — | CN | claimed |
| EP-0009560-A1 | 1,4-Dihydropyridazine-3-carbonyl compounds, process for their preparation, the compounds for use in curing diseases, medicaments containing them and process for the preparation of the medicaments | BAYER AG (DE) | 1980-04-16 | — | — | EP | claimed |
| JP-62181254-A | — | — | None | — | — | JP | disclosed |
| JP-4005272-A | — | — | None | — | — | JP | disclosed |
| JP-4026675-A | — | — | None | — | — | JP | disclosed |
| JP-3011064-A | — | — | None | — | — | JP | disclosed |
| CN-115260087-A | Nicardipine hydrochloride impurity and synthesis method and application thereof | 济南良福精合医药科技有限公司 | 2022-11-01 | — | — | CN | disclosed |
| CN-107954857-A | A kind of brufen resolution process and the purification process based on the resolution process | 潍坊新益制药技术有限公司 | 2018-04-24 | — | — | CN | disclosed |
| EP-0638568-B1 | Substituted piperazines, their process of preparation and the pharmaceutical compositions containing them | ADIR (FR) | 1996-10-09 | — | — | EP | disclosed |
| US-5500426-A | ADMINISTERED TO IMPROVE GLUCOSE TOLERANCE | ADIR ET COMPAGNIE (FR) | 1996-03-19 | — | — | US | disclosed |
| US-4902727-A | Compounds having a polymerizable acylurethane structure, and their production and process of using | NIPPON PAINT CO., LTD. (JP) | 1990-02-20 | — | — | US | disclosed |
| JP-S62181254-A | PRODUCTION OF 1,4-DIHYDROPYRIDINE OR SUCH | ASAHI CHEM IND CO LTD | 1987-08-08 | — | — | JP | disclosed |
| EP-0204497-A1 | Polymerisation process employing compounds having polymerisable acylurethane structures | Nippon Paint Co., Ltd. (JP) | 1986-12-10 | — | — | EP | disclosed |
| EP-0041757-B1 | ETHYLENDIAMINE DERIVATIVES, PREPARATION THEREOF, PHARMACEUTICAL COMPOSITIONS CONTAINING SAME AND INTERMEDIATES FOR THEIR PREPARATION | Simes S.p.A. (IT) | 1984-11-07 | — | — | EP | disclosed |
| US-4467094-A | Precursors to ethylenediamine derivatives | SIMES S.P.A. (IT) | 1984-08-21 | — | — | US | disclosed |
| US-4381305-A | Ethylenediamine derivatives and pharmaceutical compositions containing same | SIMES S.P.A. (IT) | 1983-04-26 | — | — | US | disclosed |
| EP-0009560-B1 | 1,4-DIHYDROPYRIDAZINE-3-CARBONYL COMPOUNDS, PROCESS FOR THEIR PREPARATION, THE COMPOUNDS FOR USE IN CURING DISEASES, MEDICAMENTS CONTAINING THEM AND PROCESS FOR THE PREPARATION OF THE MEDICAMENTS | BAYER AG (DE) | 1982-09-22 | — | — | EP | disclosed |
| EP-0041757-A1 | Ethylendiamine derivatives, preparation thereof, pharmaceutical compositions containing same and intermediates for their preparation | Simes S.p.A. (IT) | 1981-12-16 | — | — | EP | disclosed |
| US-4280998-A | 1,4-Dihydropyridazine-3-carboxylic acid derivatives, a process for their preparation and their use as antihypertensives | BAYER AKTIENGESELLSCHAFT (DE) | 1981-07-28 | — | — | US | disclosed |