BDBM50004058 (2S)-2-(butylsulfonylamino)-3-[4-(4-piperidin-4-ylbutoxy)phenyl]propanoic acid::N-(Butylsulfonyl)-O-(4-(4-piperidyl)butyl)-L-tyrosine::N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyrosine::tirofiban

SMILES: CCCCS(=O)(=O)N[C@@H](Cc1ccc(cc1)OCCCCC2CCNCC2)C(=O)O

InChI Key: InChIKey=COKMIXFXJJXBQG-UHFFFAOYSA-N

Data: 36 IC50  4 Kd  1 EC50

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 41 hits for monomerid = 50004058   

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
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.950	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin beta-3 (Rat)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	136	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.370	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.950	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	13.6	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin beta-3 (Rat)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.370	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.40	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-2/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-2/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.90	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.60E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-5/beta-1 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-5/beta-1 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.60E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.30	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	1.90	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.30	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9.40	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Human)	BDBM50004058 (N-(butylsulfonyl)-O-(4-piperidin-4-ylbutyl)-L-tyro...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair