BDBM16801 (2S)-2-[(2,6-dichlorophenyl)formamido]-3-[4-(2,6-dimethoxyphenyl)phenyl]propanoic acid::CHEMBL91485::N-Acyl-4-arylphenylalanine analogue.::SB683698

SMILES: COc1cccc(OC)c1-c1ccc(C[C@H](NC(=O)c2c(Cl)cccc2Cl)C(O)=O)cc1

InChI Key: InChIKey=DRSJLVGDSNWQBI-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 16801   

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-4/beta-1 [T112H] (Human)	BDBM16801 (CHEMBL91485 | N-Acyl-4-arylphenylalanine analogue....) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	200	n/a	n/a	n/a	n/a	7.4	22
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Integrin alpha-4/beta-7 (Human)	BDBM16801 (CHEMBL91485 | N-Acyl-4-arylphenylalanine analogue....) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	58	n/a	n/a	n/a	n/a	n/a	4
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					More data for this Ligand-Target Pair
Integrin alpha-4/beta-7 (Human)	BDBM16801 (CHEMBL91485 | N-Acyl-4-arylphenylalanine analogue....) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.75	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-4/beta-1 (Human)	BDBM16801 (CHEMBL91485 | N-Acyl-4-arylphenylalanine analogue....) 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-4/beta-1 (Human)	BDBM16801 (CHEMBL91485 | N-Acyl-4-arylphenylalanine analogue....) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	61	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair