BindingDB PrimarySearch_ki

Search and Browse
- Target
- Compound
- Special tools
- Citation
- Special Data Sets
- Other Databases
  - PDB 85% 100% Seq ID
  - UniProtKB/Swiss-Prot
  - UniProtKB/TrEMBL
  - PubMed
Download
- All Compounds & Data
- Target Names &
  - Ki IC50 Kd EC50
  - ΔG° ΔH° -TΔS°
Enter Data

BDBM50319977 2-(4-methylpiperidin-1-yl)-N-phenethylpyrimidin-4-amine::CHEMBL1082981

SMILES: CC1CCN(CC1)c1nccc(NCCc2ccccc2)n1

InChI Key: InChIKey=JAXXPQUWOTTXGC-UHFFFAOYSA-N

Data: 4 IC50

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50319977
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Acetylcholinesterase (Electric eel)	BDBM50319977 (2-(4-methylpiperidin-1-yl)-N-phenethylpyrimidin-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Cholinesterase (Horse)	BDBM50319977 (2-(4-methylpiperidin-1-yl)-N-phenethylpyrimidin-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.77E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Horse)	BDBM50319977 (2-(4-methylpiperidin-1-yl)-N-phenethylpyrimidin-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.77E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Acetylcholinesterase (Human)	BDBM50319977 (2-(4-methylpiperidin-1-yl)-N-phenethylpyrimidin-4-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair