Benzylamine

Benzylamine

SCHEMBL8533923

NCc1ccccc1.O=C(O)/C=C\C(=O)O

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2BTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3MPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PPARGSLC6A2SLC6A3SLC6A4SMOTYK2pol

The experimentally established mechanism targets of Benzylamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.64
CYP2D6 P10635 2/20 0.57
CYP2C19 P33261 2/20 0.57
CYP1A2 P05177 1/20 0.57
CYP2C9 P11712 1/20 0.57
TSHR P16473 1/20 0.57
HCAR2 Q8TDS4 6/20 0.55
ALDH1A1 P00352 3/20 0.55
LMNA P02545 1/20 0.55
TAAR1 Q96RJ0 4/20 0.52
KDM4E B2RXH2 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
SLC15A1 P46059 1/20 0.49
HDAC3 O15379 1/20 0.46
TNKS O95271 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46

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.

Compoundsimilaritytop predictedshared targets
Benzylamine SCHEMBL8533927 1.00 LOXL2 (0.64) LOXL2CYP2D6CYP2C19CYP1A2CYP2C9
Benzylamine SCHEMBL10445229 1.00 LOXL2 (0.64) LOXL2CYP2D6CYP2C19CYP1A2CYP2C9
Benzylamine SCHEMBL2800847 0.91 LOXL2 (0.58) LOXL2CYP2D6CYP2C19CYP1A2CYP2C9
Benzylamine SCHEMBL2800850 0.91 LOXL2 (0.58) LOXL2CYP2D6CYP2C19CYP1A2CYP2C9
Benzylamine SCHEMBL2841170 0.85 LOXL2 (0.78) LOXL2CYP2D6CYP2C19CYP1A2CYP2C9
Benzylamine SCHEMBL2841167 0.85 LOXL2 (0.78) LOXL2CYP2D6CYP2C19CYP1A2CYP2C9
Benzylamine SCHEMBL11588019 0.84 LOXL2 (0.61) LOXL2CYP2D6CYP2C19CYP1A2CYP2C9
Benzylamine SCHEMBL25352130 0.83 LOXL2 (0.74) LOXL2CYP2D6CYP2C19CYP1A2CYP2C9
Benzylamine SCHEMBL3188490 0.83 LOXL2 (0.74) LOXL2CYP2D6CYP2C19CYP1A2CYP2C9
Benzylamine SCHEMBL3891720 0.83 LOXL2 (0.74) LOXL2CYP2D6CYP2C19CYP1A2CYP2C9

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115714235-A Separator and battery including the same 武汉微美新材料科技有限公司 2023-02-24 CN disclosed
CN-115347324-A Ceramic coating, and diaphragm and lithium ion battery comprising same 武汉微美新材料科技有限公司 2022-11-15 CN disclosed
CN-114975939-A Water-based cathode slurry, cathode pole piece and lithium ion battery 武汉微美新材料科技有限公司 2022-08-30 CN disclosed
EP-0859757-A1 DERIVATES OF N,N-DIMETHYL-2-(ARYLTHIO)BENZYLAMINE, THEIR SALTS, METHODS OF PREPARATION AND THEIR USE IN PHARMACEUTICAL MEDICAMENTS Farmak A.S. (CZ) 1998-08-26 EP disclosed
WO-1997017325-A1 DERIVATES OF N,N-DIMETHYL-2-(ARYLTHIO)BENZYLAMINE, THEIR SALTS, METHODS OF PREPARATION AND THEIR USE IN PHARMACEUTICAL MEDICAMENTS FARMAK A.S. (CZ) 1997-05-15 WO disclosed
CN-1042910-A The allylamine derivatives that replaces, their production method and application thereof BANYU PHARMA CO LTD (JP) 1990-06-13 CN disclosed