BDBM79035 MLS001029145::N-[[1-(4-chlorobenzyl)-4-piperidyl]methyl]-1-(7,8,9,10-tetrahydro-6H-purin[9,8-a]azepin-4-yl)nipecotamide::N-[[1-[(4-chlorophenyl)methyl]-4-piperidinyl]methyl]-1-(7,8,9,10-tetrahydro-6H-purino[9,8-a]azepin-4-yl)-3-piperidinecarboxamide::N-[[1-[(4-chlorophenyl)methyl]piperidin-4-yl]methyl]-1-(7,8,9,10-tetrahydro-6H-purino[9,8-a]azepin-4-yl)piperidine-3-carboxamide::SMR000629112::cid_20912355

SMILES: Clc1ccc(CN2CCC(CNC(=O)C3CCCN(C3)c3ncnc4n5CCCCCc5nc34)CC2)cc1

InChI Key: InChIKey=DLXQIDMLWQCEFE-UHFFFAOYSA-N

Data: 4 IC50

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 4 hits for monomerid = 79035   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Ubiquitin-conjugating enzyme E2 N (Human)	BDBM79035 (N-[[1-[(4-chlorophenyl)methyl]piperidin-4-yl]methy...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Ubiquitin-conjugating enzyme E2 N (Human)	BDBM79035 (N-[[1-[(4-chlorophenyl)methyl]piperidin-4-yl]methy...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.14E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Bcl-2-related protein A1 (Mouse)	BDBM79035 (N-[[1-[(4-chlorophenyl)methyl]piperidin-4-yl]methy...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Galanin receptor type 3 (Human)	BDBM79035 (N-[[1-[(4-chlorophenyl)methyl]piperidin-4-yl]methy...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>2.99E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair