Compile Data Set for Download or QSAR

Found 21 hits with Last Name = 'gandour' and Initial = 'rd'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Carnitine O-palmitoyltransferase 1, muscle isoform (Rattus norvegicus)	BDBM50046145 (2-[6-hydroxy-4,4-dimethyl-6-pentadecyl-(2R,6S)-1,4...) Show SMILES CCCCCCCCCCCCCCC[C@@]1(O)C[N+](C)(C)C[C@@H](CC([O-])=O)O1 Show InChI InChI=1S/C23H45NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(27)20-24(2,3)19-21(28-23)18-22(25)26/h21,27H,4-20H2,1-3H3/t21-,23+/m1/s1	Reactome pathway UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Louisiana State University Curated by ChEMBL					Assay Description Compound was evaluated for its ability to inhibit carnitine palmitoyltransferase I activity in intact mitochondria from rat heart				J Med Chem 36: 237-42 (1993) BindingDB Entry DOI: 10.7270/Q2P849ZC
					More data for this Ligand-Target Pair
Carnitine O-palmitoyltransferase 1, liver isoform (Rattus norvegicus)	BDBM50046145 (2-[6-hydroxy-4,4-dimethyl-6-pentadecyl-(2R,6S)-1,4...) Show SMILES CCCCCCCCCCCCCCC[C@@]1(O)C[N+](C)(C)C[C@@H](CC([O-])=O)O1 Show InChI InChI=1S/C23H45NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(27)20-24(2,3)19-21(28-23)18-22(25)26/h21,27H,4-20H2,1-3H3/t21-,23+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	4.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Louisiana State University Curated by ChEMBL					Assay Description Compound was evaluated for its ability to inhibit carnitine palmitoyltransferase I activity in intact mitochondria from rat liver				J Med Chem 36: 237-42 (1993) BindingDB Entry DOI: 10.7270/Q2P849ZC
					More data for this Ligand-Target Pair
Protein kinase C zeta type (Rattus norvegicus)	BDBM50230709 (CHEMBL295954) Show SMILES [Br-].CCCCCCCCCCCCCCCC1(C[N+](C)(C)CCO1)OC Show InChI InChI=1S/C22H46NO2.BrH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(24-4)21-23(2,3)19-20-25-22;/h5-21H2,1-4H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Louisiana State University Curated by ChEMBL					Assay Description Inhibition of protein kinase C (PKC) purified from rat brain				J Med Chem 36: 177-8 (1993) BindingDB Entry DOI: 10.7270/Q2Z321VQ
					More data for this Ligand-Target Pair
Protein kinase C zeta type (Rattus norvegicus)	BDBM50230703 (CHEMBL296591) Show SMILES [Br-].CCCCCCCCCCCCCCCCCCC1(O)C[N+](C)(C)CCO1 Show InChI InChI=1S/C24H50NO2.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24(26)23-25(2,3)21-22-27-24;/h26H,4-23H2,1-3H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Louisiana State University Curated by ChEMBL					Assay Description Inhibition of protein kinase C (PKC) purified from rat brain				J Med Chem 36: 177-8 (1993) BindingDB Entry DOI: 10.7270/Q2Z321VQ
					More data for this Ligand-Target Pair
Protein kinase C zeta type (Rattus norvegicus)	BDBM50230702 (CHEMBL48695) Show SMILES [Br-].CCCCCCCCCCCCCCCC(=O)C[N+](C)(C)CCCO Show InChI InChI=1S/C22H46NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18-22(25)21-23(2,3)19-17-20-24/h24H,4-21H2,1-3H3/q+1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Louisiana State University Curated by ChEMBL					Assay Description Inhibition of protein kinase C (PKC) purified from rat brain				J Med Chem 36: 177-8 (1993) BindingDB Entry DOI: 10.7270/Q2Z321VQ
					More data for this Ligand-Target Pair
Protein kinase C zeta type (Rattus norvegicus)	BDBM50230712 (CHEMBL52232) Show SMILES [Br-].CCCCCCCCCCCCCCCCCC1(O)C[N+](C)(C)CCO1 Show InChI InChI=1S/C23H48NO2.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(25)22-24(2,3)20-21-26-23;/h25H,4-22H2,1-3H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	7.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Louisiana State University Curated by ChEMBL					Assay Description Inhibition of protein kinase C (PKC) purified from rat brain				J Med Chem 36: 177-8 (1993) BindingDB Entry DOI: 10.7270/Q2Z321VQ
					More data for this Ligand-Target Pair
Protein kinase C zeta type (Rattus norvegicus)	BDBM50230714 (CHEMBL48551) Show SMILES [Br-].CCCCCCCCCCCCCCCC1(O)C[N+](C)(C)CCO1 Show InChI InChI=1S/C21H44NO2.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(23)20-22(2,3)18-19-24-21;/h23H,4-20H2,1-3H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	7.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Louisiana State University Curated by ChEMBL					Assay Description Inhibition of protein kinase C (PKC) purified from rat brain				J Med Chem 36: 177-8 (1993) BindingDB Entry DOI: 10.7270/Q2Z321VQ
					More data for this Ligand-Target Pair
Protein kinase C zeta type (Rattus norvegicus)	BDBM50230705 (CHEMBL49951) Show SMILES [Br-].CCCCCCCCCCCCCCCCC1(O)C[N+](C)(C)CCO1 Show InChI InChI=1S/C22H46NO2.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(24)21-23(2,3)19-20-25-22;/h24H,4-21H2,1-3H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	7.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Louisiana State University Curated by ChEMBL					Assay Description Inhibition of protein kinase C (PKC) purified from rat brain				J Med Chem 36: 177-8 (1993) BindingDB Entry DOI: 10.7270/Q2Z321VQ
					More data for this Ligand-Target Pair
Protein kinase C zeta type (Rattus norvegicus)	BDBM50230711 (CHEMBL441041) Show SMILES [Br-].CCCCCCCCCCCCCCC1(O)C[N+](C)(C)CCO1 Show InChI InChI=1S/C20H42NO2.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-20(22)19-21(2,3)17-18-23-20;/h22H,4-19H2,1-3H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	7.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Louisiana State University Curated by ChEMBL					Assay Description Inhibition of protein kinase C (PKC) purified from rat brain				J Med Chem 36: 177-8 (1993) BindingDB Entry DOI: 10.7270/Q2Z321VQ
					More data for this Ligand-Target Pair
Protein kinase C zeta type (Rattus norvegicus)	BDBM50230704 (CHEMBL416830) Show SMILES [Br-].CCCCCCCCCCCCCC1(O)C[N+](C)(C)CCO1 Show InChI InChI=1S/C19H40NO2.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-19(21)18-20(2,3)16-17-22-19;/h21H,4-18H2,1-3H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Louisiana State University Curated by ChEMBL					Assay Description Inhibition of protein kinase C (PKC) purified from rat brain				J Med Chem 36: 177-8 (1993) BindingDB Entry DOI: 10.7270/Q2Z321VQ
					More data for this Ligand-Target Pair
Protein kinase C zeta type (Rattus norvegicus)	BDBM50230713 (CHEMBL301124) Show SMILES [Br-].CCCCCCCCCCCCC1(O)C[N+](C)(C)CCO1 Show InChI InChI=1S/C18H38NO2.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-18(20)17-19(2,3)15-16-21-18;/h20H,4-17H2,1-3H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Louisiana State University Curated by ChEMBL					Assay Description Inhibition of protein kinase C (PKC) purified from rat brain				J Med Chem 36: 177-8 (1993) BindingDB Entry DOI: 10.7270/Q2Z321VQ
					More data for this Ligand-Target Pair
Protein kinase C zeta type (Rattus norvegicus)	BDBM50230701 (CHEBI:73067 | Palmitoyl-carnitine) Show SMILES CCCCCCCCCCCCCCCC(=O)OC(CC([O-])=O)C[N+](C)(C)C Show InChI InChI=1S/C23H45NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(27)28-21(19-22(25)26)20-24(2,3)4/h21H,5-20H2,1-4H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.58E+4	n/a	n/a	n/a	n/a	n/a	n/a
Louisiana State University Curated by ChEMBL					Assay Description Inhibition of protein kinase C (PKC) purified from rat brain				J Med Chem 36: 177-8 (1993) BindingDB Entry DOI: 10.7270/Q2Z321VQ
					More data for this Ligand-Target Pair
Protein kinase C zeta type (Rattus norvegicus)	BDBM50046145 (2-[6-hydroxy-4,4-dimethyl-6-pentadecyl-(2R,6S)-1,4...) Show SMILES CCCCCCCCCCCCCCC[C@@]1(O)C[N+](C)(C)C[C@@H](CC([O-])=O)O1 Show InChI InChI=1S/C23H45NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(27)20-24(2,3)19-21(28-23)18-22(25)26/h21,27H,4-20H2,1-3H3/t21-,23+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	4.96E+4	n/a	n/a	n/a	n/a	n/a	n/a
Louisiana State University Curated by ChEMBL					Assay Description Inhibition of protein kinase C (PKC) purified from rat brain				J Med Chem 36: 177-8 (1993) BindingDB Entry DOI: 10.7270/Q2Z321VQ
					More data for this Ligand-Target Pair
Carnitine O-palmitoyltransferase 1, liver isoform (Rattus norvegicus)	BDBM50284163 ((S)-4-Hexadecyl-2,6,6-trimethyl-2-oxo-2lambda*5*-[...) Show SMILES CCCCCCCCCCCCCCCCC1C[N+](C)(C)CCO[P@](C)(=O)O1 Show InChI InChI=1S/C23H49NO3P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-22-24(2,3)20-21-26-28(4,25)27-23/h23H,5-22H2,1-4H3/q+1/t23?,28-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	n/a	n/a	1.28E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory potency of the compound against Carnitine Palmitoyltransferase (CPT-II)				Bioorg Med Chem Lett 4: 883-886 (1994) Article DOI: 10.1016/S0960-894X(01)80256-0 BindingDB Entry DOI: 10.7270/Q2RX9C15
					More data for this Ligand-Target Pair
Protein kinase C zeta type (Rattus norvegicus)	BDBM50230710 (CHEMBL49275) Show SMILES [Br-].CCCCCCCCCCC1(O)C[N+](C)(C)CCO1 Show InChI InChI=1S/C16H34NO2.BrH/c1-4-5-6-7-8-9-10-11-12-16(18)15-17(2,3)13-14-19-16;/h18H,4-15H2,1-3H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.70E+5	n/a	n/a	n/a	n/a	n/a	n/a
Louisiana State University Curated by ChEMBL					Assay Description Inhibition of protein kinase C (PKC) purified from rat brain				J Med Chem 36: 177-8 (1993) BindingDB Entry DOI: 10.7270/Q2Z321VQ
					More data for this Ligand-Target Pair
Carnitine O-palmitoyltransferase 2, mitochondrial (Homo sapiens (Human))	BDBM50284164 ((S)-2-Hexadecyl-2-hydroxy-4,4-dimethyl-morpholin-4...) Show SMILES CCCCCCCCCCCCCCCC[C@@]1(O)C[N+](C)(C)CCO1 Show InChI InChI=1S/C22H46NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(24)21-23(2,3)19-20-25-22/h24H,4-21H2,1-3H3/q+1/t22-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.35E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory potency of the compound against Carnitine Palmitoyltransferase (CPT-II); Range = 32-235 microM				Bioorg Med Chem Lett 4: 883-886 (1994) Article DOI: 10.1016/S0960-894X(01)80256-0 BindingDB Entry DOI: 10.7270/Q2RX9C15
					More data for this Ligand-Target Pair
Carnitine O-palmitoyltransferase 1, liver isoform (Rattus norvegicus)	BDBM50284163 ((S)-4-Hexadecyl-2,6,6-trimethyl-2-oxo-2lambda*5*-[...) Show SMILES CCCCCCCCCCCCCCCCC1C[N+](C)(C)CCO[P@](C)(=O)O1 Show InChI InChI=1S/C23H49NO3P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-22-24(2,3)20-21-26-28(4,25)27-23/h23H,5-22H2,1-4H3/q+1/t23?,28-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	n/a	n/a	3.05E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory potency of the compound against Carnitine Palmitoyltransferase (CPT-II)				Bioorg Med Chem Lett 4: 883-886 (1994) Article DOI: 10.1016/S0960-894X(01)80256-0 BindingDB Entry DOI: 10.7270/Q2RX9C15
					More data for this Ligand-Target Pair
Peroxisomal carnitine O-octanoyltransferase (Homo sapiens (Human))	BDBM50284163 ((S)-4-Hexadecyl-2,6,6-trimethyl-2-oxo-2lambda*5*-[...) Show SMILES CCCCCCCCCCCCCCCCC1C[N+](C)(C)CCO[P@](C)(=O)O1 Show InChI InChI=1S/C23H49NO3P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-22-24(2,3)20-21-26-28(4,25)27-23/h23H,5-22H2,1-4H3/q+1/t23?,28-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	n/a	n/a	4.75E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory potency of the compound against carnitine octanoyltransferase (COT)				Bioorg Med Chem Lett 4: 883-886 (1994) Article DOI: 10.1016/S0960-894X(01)80256-0 BindingDB Entry DOI: 10.7270/Q2RX9C15
					More data for this Ligand-Target Pair
Peroxisomal carnitine O-octanoyltransferase (Homo sapiens (Human))	BDBM50284163 ((S)-4-Hexadecyl-2,6,6-trimethyl-2-oxo-2lambda*5*-[...) Show SMILES CCCCCCCCCCCCCCCCC1C[N+](C)(C)CCO[P@](C)(=O)O1 Show InChI InChI=1S/C23H49NO3P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-22-24(2,3)20-21-26-28(4,25)27-23/h23H,5-22H2,1-4H3/q+1/t23?,28-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	n/a	n/a	9.12E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory potency of the compound against carnitine octanoyltransferase (COT)				Bioorg Med Chem Lett 4: 883-886 (1994) Article DOI: 10.1016/S0960-894X(01)80256-0 BindingDB Entry DOI: 10.7270/Q2RX9C15
					More data for this Ligand-Target Pair
Peroxisomal carnitine O-octanoyltransferase (Homo sapiens (Human))	BDBM50284164 ((S)-2-Hexadecyl-2-hydroxy-4,4-dimethyl-morpholin-4...) Show SMILES CCCCCCCCCCCCCCCC[C@@]1(O)C[N+](C)(C)CCO1 Show InChI InChI=1S/C22H46NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(24)21-23(2,3)19-20-25-22/h24H,4-21H2,1-3H3/q+1/t22-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	4.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory potency of the compound against carnitine octanoyltransferase (COT); Range = 1300-4000 microM				Bioorg Med Chem Lett 4: 883-886 (1994) Article DOI: 10.1016/S0960-894X(01)80256-0 BindingDB Entry DOI: 10.7270/Q2RX9C15
					More data for this Ligand-Target Pair
LanC-like protein 2 (Homo sapiens (Human))	BDBM50558735 (CHEMBL4788758) Show SMILES O=C(N1CCN(CC1)C(=O)c1cccc(n1)-c1nc2ccccc2[nH]1)c1cccc(n1)-c1nc2ccccc2[nH]1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	7.70E+3	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to LANCL2 (unknown origin) by surface plasmon resonance analysis				Citation and Details BindingDB Entry DOI: 10.7270/Q2Q243XP
					More data for this Ligand-Target Pair