BDBM50122836 CHEMBL102993::[3-Carboxy-2-(3-tetradecyl-ureido)-propyl]-trimethyl-ammonium

SMILES: CCCCCCCCCCCCCCNC(=O)N[C@@H](CC([O-])=O)C[N+](C)(C)C

InChI Key: InChIKey=BMZYTDRMCBZVNH-FQEVSTJZSA-N

Data: 1 KI  2 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 3 hits for monomerid = 50122836   

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
Carnitine palmitoyltransferase 1A (Rattus norvegicus)	BDBM50122836 (CHEMBL102993 | [3-Carboxy-2-(3-tetradecyl-ureido)-...) Show SMILES CCCCCCCCCCCCCCNC(=O)N[C@@H](CC([O-])=O)C[N+](C)(C)C Show InChI InChI=1S/C22H45N3O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-23-22(28)24-20(18-21(26)27)19-25(2,3)4/h20H,5-19H2,1-4H3,(H2-,23,24,26,27,28)/t20-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid UniChem Similars	Article PubMed	360	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sigma Tau Pharmaceutical Industries S.p.A. Curated by ChEMBL					Assay Description Inhibition of rat liver carnitine palmitoyltransferase I				J Med Chem 46: 303-9 (2003) Article DOI: 10.1021/jm020979u BindingDB Entry DOI: 10.7270/Q2N015WM
					More data for this Ligand-Target Pair
Carnitine palmitoyltransferase 1A (Rattus norvegicus)	BDBM50122836 (CHEMBL102993 | [3-Carboxy-2-(3-tetradecyl-ureido)-...) Show SMILES CCCCCCCCCCCCCCNC(=O)N[C@@H](CC([O-])=O)C[N+](C)(C)C Show InChI InChI=1S/C22H45N3O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-23-22(28)24-20(18-21(26)27)19-25(2,3)4/h20H,5-19H2,1-4H3,(H2-,23,24,26,27,28)/t20-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.88E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sigma Tau Pharmaceutical Industries S.p.A. Curated by ChEMBL					Assay Description Inhibition of [14C]-palmitoyl-CoA and carnitine binding to carnitine palmitoyltransferase I from rat liver mitochondria				J Med Chem 46: 303-9 (2003) Article DOI: 10.1021/jm020979u BindingDB Entry DOI: 10.7270/Q2N015WM
					More data for this Ligand-Target Pair
Carnitine palmitoyltransferase 1B (Rattus norvegicus)	BDBM50122836 (CHEMBL102993 | [3-Carboxy-2-(3-tetradecyl-ureido)-...) Show SMILES CCCCCCCCCCCCCCNC(=O)N[C@@H](CC([O-])=O)C[N+](C)(C)C Show InChI InChI=1S/C22H45N3O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-23-22(28)24-20(18-21(26)27)19-25(2,3)4/h20H,5-19H2,1-4H3,(H2-,23,24,26,27,28)/t20-/m0/s1	Reactome pathway UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.67E+5	n/a	n/a	n/a	n/a	n/a	n/a
Sigma Tau Pharmaceutical Industries S.p.A. Curated by ChEMBL					Assay Description In vitro inhibition of [14C]-palmitoyl-CoA and carnitine binding to carnitine palmitoyltransferase I of rat heart mitochondria				J Med Chem 46: 303-9 (2003) Article DOI: 10.1021/jm020979u BindingDB Entry DOI: 10.7270/Q2N015WM
					More data for this Ligand-Target Pair