BDBM119875 3,7,11,15-tetramethylhexadecanoic acid::Phytanic acid

SMILES: CC(C)CCCC(C)CCCC(C)CCCC(C)CC(O)=O

InChI Key: InChIKey=RLCKHJSFHOZMDR-UHFFFAOYSA-N

Data: 3 KI

PDB links: 1 PDB ID matches this monomer.

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 3 hits for monomerid = 119875   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Liver fatty acid binding protein (human L-FABP T94T) (Homo sapiens (Human))	BDBM119875 (3,7,11,15-tetramethylhexadecanoic acid | Phytanic ...) Show SMILES CC(C)CCCC(C)CCCC(C)CCCC(C)CC(O)=O Show InChI InChI=1S/C20H40O2/c1-16(2)9-6-10-17(3)11-7-12-18(4)13-8-14-19(5)15-20(21)22/h16-19H,6-15H2,1-5H3,(H,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase KEGG PC cid PC sid PDB UniChem Similars	Article PubMed	35	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Texas A&M University					Assay Description A solution of the L-FABP (500 nM) and ANS (35 µM) was titrated with phytanic acid (0-6.4 µM) or fenofibrate (0-6 µM for the rat L-FABP...				Biochemistry 52: 9347-57 (2013) Article DOI: 10.1021/bi401014k BindingDB Entry DOI: 10.7270/Q2FB51MG
					More data for this Ligand-Target Pair
Liver fatty acid binding protein (rat L-FABP) (Rattus norvegicus (Rat))	BDBM119875 (3,7,11,15-tetramethylhexadecanoic acid | Phytanic ...) Show SMILES CC(C)CCCC(C)CCCC(C)CCCC(C)CC(O)=O Show InChI InChI=1S/C20H40O2/c1-16(2)9-6-10-17(3)11-7-12-18(4)13-8-14-19(5)15-20(21)22/h16-19H,6-15H2,1-5H3,(H,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase KEGG PC cid PC sid PDB UniChem Similars	Article PubMed	37	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Texas A&M University					Assay Description A solution of the L-FABP (500 nM) and ANS (35 µM) was titrated with phytanic acid (0-6.4 µM) or fenofibrate (0-6 µM for the rat L-FABP...				Biochemistry 52: 9347-57 (2013) Article DOI: 10.1021/bi401014k BindingDB Entry DOI: 10.7270/Q2FB51MG
					More data for this Ligand-Target Pair
Liver fatty acid binding protein (human L-FABP T94A) (Homo sapiens (Human))	BDBM119875 (3,7,11,15-tetramethylhexadecanoic acid | Phytanic ...) Show SMILES CC(C)CCCC(C)CCCC(C)CCCC(C)CC(O)=O Show InChI InChI=1S/C20H40O2/c1-16(2)9-6-10-17(3)11-7-12-18(4)13-8-14-19(5)15-20(21)22/h16-19H,6-15H2,1-5H3,(H,21,22)	PDB MMDB B.MOAD GoogleScholar AffyNet	Purchase KEGG PC cid PC sid PDB UniChem Similars	Article PubMed	38	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Texas A&M University					Assay Description A solution of the L-FABP (500 nM) and ANS (35 µM) was titrated with phytanic acid (0-6.4 µM) or fenofibrate (0-6 µM for the rat L-FABP...				Biochemistry 52: 9347-57 (2013) Article DOI: 10.1021/bi401014k BindingDB Entry DOI: 10.7270/Q2FB51MG
					More data for this Ligand-Target Pair