BDBM50235980 2-((2S,5R,8S,11S)-5-benzyl-11-(3-guanidinopropyl)-8-isopropyl-7-methyl-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentaazacyclopentadecan-2-yl)acetic acid::CHEMBL429876::CILENGITIDE::EMD-12192::EMD-121974::[(2S,5R,8S,11S)-5-benzyl-11-(3-guanidino-propyl)-8-isopropyl-7-methyl-3,6,9,12,15-pentaoxo-1,4,7,10,13pentaaza-cyclopentadec-2-yl]-acetic acid::c(RGDfMeV)::cyclo(Arg-Gly-Asp-D-Phe-[N-Me]Val)

SMILES: [#6]-[#6](-[#6])-[#6@@H]-1-[#7](-[#6])-[#6](=O)-[#6@@H](-[#6]-c2ccccc2)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6]-1=O

InChI Key: InChIKey=LJKWPNDKPDWWIA-UHFFFAOYSA-N

Data: 1 KI  50 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 51 hits for monomerid = 50235980   

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-V/beta-3 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.510	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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	18.9	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-V/beta-3 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.860	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-5 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-5 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.130	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-V/beta-3 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	18.9	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-V/beta-5 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.130	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-V/beta-3 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	18.9	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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.21E+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-V/beta-6 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.66E+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-V/beta-5 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.60	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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.540	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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) 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-5 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.130	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-V/beta-3 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.540	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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) 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-IIb/beta-3 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) 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-5/beta-1 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.00E+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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.06E+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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	200	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-5 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.40E+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-5/beta-1 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.01E+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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.44E+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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	900	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-5 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.50E+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-V/beta-3 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.400	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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.540	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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) 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-5 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	12	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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	13	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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.650	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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.580	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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.540	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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) 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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	230	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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.540	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-5 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8	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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) 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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.540	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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) 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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	220	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)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	110	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-5 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	350	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-5 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.130	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-V/beta-3 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	18.9	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-V/beta-3 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.40E+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-5/beta-1 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.20E+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-V (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	18.9	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-V (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.130	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-V/beta-3 (Human)	BDBM50235980 (CHEMBL429876 | EMD-121974 | cyclo(Arg-Gly-Asp-D-Ph...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.600	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair