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SMILES: COc1ccc2ccc3OC(C(N)Cc3c2c1)c1ccccc1Cl

InChI Key: InChIKey=LNNFZIBJOVMTKU-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 420967   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Dipeptidyl peptidase 4


(Homo sapiens (Human))		BDBM420967
PNG
(US10479798, Compound 26)
Show SMILES COc1ccc2ccc3OC(C(N)Cc3c2c1)c1ccccc1Cl |w:11.11,10.19|
Show InChI InChI=1S/C20H18ClNO2/c1-23-13-8-6-12-7-9-19-16(15(12)10-13)11-18(22)20(24-19)14-4-2-3-5-17(14)21/h2-10,18,20H,11,22H2,1H3
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n/an/a 338n/an/an/an/an/an/a



EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Screening Method:Name of method: Activity Evaluation of DPP4, Fluorescence.Instrument: Microplate reader, Envision (PerkinElmer, USA).Material: human...

US Patent US10479798 (2019)


BindingDB Entry DOI: 10.7270/Q2377C4Z
More data for this
Ligand-Target Pair