Compile Data Set for Download or QSAR

Found 60 hits with Last Name = 'andruszkiewicz' and Initial = 'r'   

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
Glutamine--fructose-6-phosphate transaminase (isomerizing) (Saccharomyces cerevisiae (Baker's yeast))	BDBM86764 (N3-Oxoacyl derivative, 3) Show SMILES N[C@@H](CNC(=O)\C=C\C(=O)c1ccccc1)C(O)=O |r| Show InChI InChI=1S/C13H14N2O4/c14-10(13(18)19)8-15-12(17)7-6-11(16)9-4-2-1-3-5-9/h1-7,10H,8,14H2,(H,15,17)(H,18,19)/b7-6+/t10-/m0/s1	Reactome pathway UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	5.65E+4	n/a	2.70E+5	n/a	n/a	n/a	n/a	n/a	n/a
Gda£?sk University of Technology					Assay Description The inhibition assay was followed under standard conditions with saturating concentrations of both substrates to determine the IC50 values.				Chembiochem 13: 85-96 (2012) Article DOI: 10.1002/cbic.201100587 BindingDB Entry DOI: 10.7270/Q24Q7SKW
					More data for this Ligand-Target Pair
Glutamine--fructose-6-phosphate transaminase (isomerizing) (Saccharomyces cerevisiae (Baker's yeast))	BDBM86766 (N3-Oxoacyl derivative, 1) Show SMILES N[C@@H](CNC(=O)[C@@H]1O[C@H]1C(=O)c1ccccc1)C(O)=O |r| Show InChI InChI=1S/C13H14N2O5/c14-8(13(18)19)6-15-12(17)11-10(20-11)9(16)7-4-2-1-3-5-7/h1-5,8,10-11H,6,14H2,(H,15,17)(H,18,19)/t8-,10-,11+/m0/s1	Reactome pathway UniProtKB/TrEMBL GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	4.50E+5	n/a	6.60E+5	n/a	n/a	n/a	n/a	n/a	n/a
Gda£?sk University of Technology					Assay Description The inhibition assay was followed under standard conditions with saturating concentrations of both substrates to determine the IC50 values.				Chembiochem 13: 85-96 (2012) Article DOI: 10.1002/cbic.201100587 BindingDB Entry DOI: 10.7270/Q24Q7SKW
					More data for this Ligand-Target Pair
Glutamine--fructose-6-phosphate aminotransferase [isomerizing] (Candida albicans)	BDBM85322 (GlcN-6-P synthase inhibitor, 15 (racemic mixture)) Show SMILES CCN(CC)S(=O)(=O)CCC(N)C(=O)OC Show InChI InChI=1S/C9H20N2O4S/c1-4-11(5-2)16(13,14)7-6-8(10)9(12)15-3/h8H,4-7,10H2,1-3H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	KEGG PC cid PC sid UniChem		6.00E+5	n/a	1.60E+6	n/a	n/a	n/a	n/a	6.85	n/a
Technical University of Gdansk					Assay Description Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...				Bioorg Chem 25: 283-296 (1997) BindingDB Entry DOI: 10.7270/Q2RB7351
					More data for this Ligand-Target Pair
Glutamine--fructose-6-phosphate aminotransferase [isomerizing] (Candida albicans)	BDBM85312 (GlcN-6-P synthase inhibitor, 5 (racemic mixture)) Show SMILES COP(O)(=O)CCC(N)C(O)=O Show InChI InChI=1S/C5H12NO5P/c1-11-12(9,10)3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid PDB UniChem Similars		9.00E+5	n/a	2.00E+6	n/a	n/a	n/a	n/a	6.85	n/a
Technical University of Gdansk					Assay Description Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...				Bioorg Chem 25: 283-296 (1997) BindingDB Entry DOI: 10.7270/Q2RB7351
					More data for this Ligand-Target Pair
Glutamine--fructose-6-phosphate aminotransferase [isomerizing] (Candida albicans)	BDBM85316 (GlcN-6-P synthase inhibitor, 9 (racemic mixture)) Show SMILES CCN(CC)P(=O)(CCC(N)C(=O)OC)OC Show InChI InChI=1S/C10H23N2O4P/c1-5-12(6-2)17(14,16-4)8-7-9(11)10(13)15-3/h9H,5-8,11H2,1-4H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars		9.40E+5	n/a	3.60E+6	n/a	n/a	n/a	n/a	6.85	n/a
Technical University of Gdansk					Assay Description Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...				Bioorg Chem 25: 283-296 (1997) BindingDB Entry DOI: 10.7270/Q2RB7351
					More data for this Ligand-Target Pair
Glutamine--fructose-6-phosphate aminotransferase [isomerizing] (Candida albicans)	BDBM85311 (GlcN-6-P synthase inhibitor, 4 (racemic mixture)) Show SMILES COC(=O)C(N)CCP(O)(=O)OC Show InChI InChI=1S/C6H14NO5P/c1-11-6(8)5(7)3-4-13(9,10)12-2/h5H,3-4,7H2,1-2H3,(H,9,10)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars		1.20E+6	n/a	2.60E+6	n/a	n/a	n/a	n/a	6.85	n/a
Technical University of Gdansk					Assay Description Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...				Bioorg Chem 25: 283-296 (1997) BindingDB Entry DOI: 10.7270/Q2RB7351
					More data for this Ligand-Target Pair
Glutamine--fructose-6-phosphate aminotransferase [isomerizing] (Candida albicans)	BDBM85315 (GlcN-6-P synthase inhibitor, 8 (racemic mixture)) Show SMILES COC(=O)C(N)CCP(=O)(OC)N(C)C Show InChI InChI=1S/C8H19N2O4P/c1-10(2)15(12,14-4)6-5-7(9)8(11)13-3/h7H,5-6,9H2,1-4H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars		1.30E+6	n/a	4.40E+6	n/a	n/a	n/a	n/a	6.85	n/a
Technical University of Gdansk					Assay Description Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...				Bioorg Chem 25: 283-296 (1997) BindingDB Entry DOI: 10.7270/Q2RB7351
					More data for this Ligand-Target Pair
Glutamine--fructose-6-phosphate aminotransferase [isomerizing] (Candida albicans)	BDBM85320 (GlcN-6-P synthase inhibitor, 13 (racemic mixture)) Show SMILES COC(=O)C(N)CCS(C)(=N)=O Show InChI InChI=1S/C6H15N2O3S/c1-11-6(9)5(7)3-4-12(2,8)10/h5H,3-4,7H2,1-2H3,(H2,8,10)/q-1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	KEGG PC cid PC sid UniChem		1.50E+6	n/a	2.80E+6	n/a	n/a	n/a	n/a	6.85	n/a
Technical University of Gdansk					Assay Description Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...				Bioorg Chem 25: 283-296 (1997) BindingDB Entry DOI: 10.7270/Q2RB7351
					More data for this Ligand-Target Pair
Glutamine--fructose-6-phosphate aminotransferase [isomerizing] (Candida albicans)	BDBM85321 (GlcN-6-P synthase inhibitor, 14 (racemic mixture)) Show SMILES COC(=O)C(N)CCS(N)(=O)=O Show InChI InChI=1S/C5H12N2O4S/c1-11-5(8)4(6)2-3-12(7,9)10/h4H,2-3,6H2,1H3,(H2,7,9,10)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase KEGG PC cid PC sid UniChem		2.80E+6	n/a	5.50E+6	n/a	n/a	n/a	n/a	6.85	n/a
Technical University of Gdansk					Assay Description Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...				Bioorg Chem 25: 283-296 (1997) BindingDB Entry DOI: 10.7270/Q2RB7351
					More data for this Ligand-Target Pair
Glutamine--fructose-6-phosphate aminotransferase [isomerizing] (Candida albicans)	BDBM85314 (GlcN-6-P synthase inhibitor, 7 (racemic mixture)) Show SMILES CCNP(=O)(CCC(N)C(=O)OC)OC Show InChI InChI=1S/C8H19N2O4P/c1-4-10-15(12,14-3)6-5-7(9)8(11)13-2/h7H,4-6,9H2,1-3H3,(H,10,12)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars		4.40E+6	n/a	7.80E+6	n/a	n/a	n/a	n/a	6.85	n/a
Technical University of Gdansk					Assay Description Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...				Bioorg Chem 25: 283-296 (1997) BindingDB Entry DOI: 10.7270/Q2RB7351
					More data for this Ligand-Target Pair
Glutamine--fructose-6-phosphate aminotransferase [isomerizing] (Candida albicans)	BDBM85313 (GlcN-6-P synthase inhibitor, 6 (racemic mixture)) Show SMILES COC(=O)C(N)CCP(N)(=O)OC Show InChI InChI=1S/C6H15N2O4P/c1-11-6(9)5(7)3-4-13(8,10)12-2/h5H,3-4,7H2,1-2H3,(H2,8,10)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars		1.10E+7	n/a	2.50E+7	n/a	n/a	n/a	n/a	6.85	n/a
Technical University of Gdansk					Assay Description Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...				Bioorg Chem 25: 283-296 (1997) BindingDB Entry DOI: 10.7270/Q2RB7351
					More data for this Ligand-Target Pair
Glutamine--fructose-6-phosphate aminotransferase [isomerizing] (Candida albicans)	BDBM50004051 (2-Amino-4-phosphono-butyric acid | 2-Amino-4-phosp...) Show SMILES NC(CCP(O)(O)=O)C(O)=O Show InChI InChI=1S/C4H10NO5P/c5-3(4(6)7)1-2-11(8,9)10/h3H,1-2,5H2,(H,6,7)(H2,8,9,10)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars		1.20E+7	n/a	2.60E+7	n/a	n/a	n/a	n/a	6.85	n/a
Technical University of Gdansk					Assay Description Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...				Bioorg Chem 25: 283-296 (1997) BindingDB Entry DOI: 10.7270/Q2RB7351
					More data for this Ligand-Target Pair
Glutamine--fructose-6-phosphate transaminase (isomerizing) (Saccharomyces cerevisiae (Baker's yeast))	BDBM86765 (N3-Oxoacyl derivative, 4) Show SMILES CC(=O)C=CC(=O)NC[C@H](N)C(O)=O |r,w:4.4| Show InChI InChI=1S/C8H12N2O4/c1-5(11)2-3-7(12)10-4-6(9)8(13)14/h2-3,6H,4,9H2,1H3,(H,10,12)(H,13,14)/t6-/m0/s1	Reactome pathway UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.52E+7	n/a	5.60E+6	n/a	n/a	n/a	n/a	n/a	n/a
Gda£?sk University of Technology					Assay Description The inhibition assay was followed under standard conditions with saturating concentrations of both substrates to determine the IC50 values.				Chembiochem 13: 85-96 (2012) Article DOI: 10.1002/cbic.201100587 BindingDB Entry DOI: 10.7270/Q24Q7SKW
					More data for this Ligand-Target Pair
Glutamine--fructose-6-phosphate transaminase (isomerizing) (Saccharomyces cerevisiae (Baker's yeast))	BDBM86767 (N3-Oxoacyl derivative, 2) Show SMILES CC(=O)[C@@H]1O[C@H]1C(=O)NC[C@H](N)C(O)=O |r| Show InChI InChI=1S/C8H12N2O5/c1-3(11)5-6(15-5)7(12)10-2-4(9)8(13)14/h4-6H,2,9H2,1H3,(H,10,12)(H,13,14)/t4-,5-,6+/m0/s1	Reactome pathway UniProtKB/TrEMBL GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	1.94E+7	n/a	7.35E+6	n/a	n/a	n/a	n/a	n/a	n/a
Gda£?sk University of Technology					Assay Description The inhibition assay was followed under standard conditions with saturating concentrations of both substrates to determine the IC50 values.				Chembiochem 13: 85-96 (2012) Article DOI: 10.1002/cbic.201100587 BindingDB Entry DOI: 10.7270/Q24Q7SKW
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50016897 (2-(2,6-dichloroanilino)-1,3-diazacyclopentene-(2) ...) Show SMILES Clc1cccc(Cl)c1\[#7]=[#6]-1\[#7]-[#6]-[#6]-[#7]-1 Show InChI InChI=1S/C9H9Cl2N3/c10-6-2-1-3-7(11)8(6)14-9-12-4-5-13-9/h1-3H,4-5H2,(H2,12,13,14)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	366	n/a	n/a	n/a	n/a	n/a	n/a
Gda£?sk University of Technology Curated by ChEMBL					Assay Description Displacement of [3H]clonidine from imidazoline I1 receptor in Sprague-Dawley rat kidney by liquid scintillation counting				Bioorg Med Chem Lett 19: 1009-11 (2009) Article DOI: 10.1016/j.bmcl.2008.11.055 BindingDB Entry DOI: 10.7270/Q2125SJ6
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50016897 (2-(2,6-dichloroanilino)-1,3-diazacyclopentene-(2) ...) Show SMILES Clc1cccc(Cl)c1\[#7]=[#6]-1\[#7]-[#6]-[#6]-[#7]-1 Show InChI InChI=1S/C9H9Cl2N3/c10-6-2-1-3-7(11)8(6)14-9-12-4-5-13-9/h1-3H,4-5H2,(H2,12,13,14)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	366	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50256481 (([4(5)S]-4(5)-(2-aminoethyl)imidazoline) dihydrobr...) Show SMILES NCC[C@H]1CNC(N)=N1 |r,c:7| Show InChI InChI=1S/C5H12N4/c6-2-1-4-3-8-5(7)9-4/h4H,1-3,6H2,(H3,7,8,9)/t4-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	477	n/a	n/a	n/a	n/a	n/a	n/a
Gda£?sk University of Technology Curated by ChEMBL					Assay Description Displacement of [3H]clonidine from imidazoline I1 receptor in Sprague-Dawley rat kidney by liquid scintillation counting				Bioorg Med Chem Lett 19: 1009-11 (2009) Article DOI: 10.1016/j.bmcl.2008.11.055 BindingDB Entry DOI: 10.7270/Q2125SJ6
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334557 (CHEMBL1644513 | [4(5)S]-4(5)-(2-Aminoethyl)-2-(2-e...) Show SMILES CCC1(Cc2ccccc2O1)C1=NC[C@H](CCN)N1 |r,t:13| Show InChI InChI=1S/C15H21N3O/c1-2-15(14-17-10-12(18-14)7-8-16)9-11-5-3-4-6-13(11)19-15/h3-6,12H,2,7-10,16H2,1H3,(H,17,18)/t12-,15?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.01E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334550 (CHEMBL1644506 | [4(5)R]-4(5)-(2-Aminoethyl)-2-[(3-...) Show SMILES NCC[C@@H]1CN=C(Nc2cccc(c2)C(F)(F)F)N1 |r,t:5| Show InChI InChI=1S/C12H15F3N4/c13-12(14,15)8-2-1-3-9(6-8)18-11-17-7-10(19-11)4-5-16/h1-3,6,10H,4-5,7,16H2,(H2,17,18,19)/t10-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.25E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334549 (CHEMBL1644505 | [4(5)S]-4(5)-(2-Aminoethyl)-2-[(3-...) Show SMILES NCC[C@H]1CN=C(Nc2cccc(c2)C(F)(F)F)N1 |r,t:5| Show InChI InChI=1S/C12H15F3N4/c13-12(14,15)8-2-1-3-9(6-8)18-11-17-7-10(19-11)4-5-16/h1-3,6,10H,4-5,7,16H2,(H2,17,18,19)/t10-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.31E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334547 (CHEMBL1644496 | [4(5)S]-4(5)-(2-Aminoethyl)-2-[(2,...) Show SMILES NCC[C@H]1CN=C(Nc2ccc(Cl)cc2Cl)N1 |r,t:5| Show InChI InChI=1S/C11H14Cl2N4/c12-7-1-2-10(9(13)5-7)17-11-15-6-8(16-11)3-4-14/h1-2,5,8H,3-4,6,14H2,(H2,15,16,17)/t8-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.48E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334560 (CHEMBL1644516 | [4(5)R]-4(5)-(2-Aminoethyl)-2-(2,3...) Show SMILES NCC[C@@H]1CN=C(N1)C1COc2ccccc2O1 |r,c:5| Show InChI InChI=1S/C13H17N3O2/c14-6-5-9-7-15-13(16-9)12-8-17-10-3-1-2-4-11(10)18-12/h1-4,9,12H,5-8,14H2,(H,15,16)/t9-,12?/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.65E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334552 (CHEMBL1644508 | [4(5)R]-4(5)-(2-Aminoethyl)-2-[(2,...) Show SMILES NCC[C@@H]1CN=C(Nc2c(Cl)cccc2Cl)N1 |r,t:5| Show InChI InChI=1S/C11H14Cl2N4/c12-8-2-1-3-9(13)10(8)17-11-15-6-7(16-11)4-5-14/h1-3,7H,4-6,14H2,(H2,15,16,17)/t7-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.72E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334539 ((S)-4-(2-aminoethyl)-N-(2-bromophenyl)-4,5-dihydro...) Show SMILES NCC[C@H]1CN=C(Nc2ccccc2Br)N1 |r,t:5| Show InChI InChI=1S/C11H15BrN4/c12-9-3-1-2-4-10(9)16-11-14-7-8(15-11)5-6-13/h1-4,8H,5-7,13H2,(H2,14,15,16)/t8-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334559 (CHEMBL1644515 | [4(5)S]-4(5)-(2-Aminoethyl)-2-(2,3...) Show SMILES NCC[C@H]1CN=C(N1)C1COc2ccccc2O1 |r,c:5| Show InChI InChI=1S/C13H17N3O2/c14-6-5-9-7-15-13(16-9)12-8-17-10-3-1-2-4-11(10)18-12/h1-4,9,12H,5-8,14H2,(H,15,16)/t9-,12?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.11E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334548 (CHEMBL1644504 | [4(5)R]-4(5)-(2-Aminoethyl)-2-[(2,...) Show SMILES NCC[C@@H]1CN=C(Nc2ccc(Cl)cc2Cl)N1 |r,t:5| Show InChI InChI=1S/C11H14Cl2N4/c12-7-1-2-10(9(13)5-7)17-11-15-6-8(16-11)3-4-14/h1-2,5,8H,3-4,6,14H2,(H2,15,16,17)/t8-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.33E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334551 (CHEMBL1644507 | [4(5)S]-4(5)-(2-Aminoethyl)-2-[(2,...) Show SMILES NCC[C@H]1CN=C(Nc2c(Cl)cccc2Cl)N1 |r,t:5| Show InChI InChI=1S/C11H14Cl2N4/c12-8-2-1-3-9(13)10(8)17-11-15-6-7(16-11)4-5-14/h1-3,7H,4-6,14H2,(H2,15,16,17)/t7-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.75E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334545 (CHEMBL1644503 | [4(5)S]-4(5)-(2-Aminoethyl)-2-[(6-...) Show SMILES Cc1cccc(NC2=NC[C@H](CCN)N2)n1 |r,t:7| Show InChI InChI=1S/C11H17N5/c1-8-3-2-4-10(14-8)16-11-13-7-9(15-11)5-6-12/h2-4,9H,5-7,12H2,1H3,(H2,13,14,15,16)/t9-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.78E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334546 (CHEMBL1644497 | [4(5)R]-4(5)-(2-Aminoethyl)-2-[(6-...) Show SMILES Cc1cccc(NC2=NC[C@@H](CCN)N2)n1 |r,t:7| Show InChI InChI=1S/C11H17N5/c1-8-3-2-4-10(14-8)16-11-13-7-9(15-11)5-6-12/h2-4,9H,5-7,12H2,1H3,(H2,13,14,15,16)/t9-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.51E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334561 (CHEMBL1644517 | [4(5)S]-4(5)-(2-Aminoethyl)-2-[(N-...) Show SMILES NCC[C@H]1CN=C(CN(Cc2ccccc2)c2ccccc2)N1 |r,t:5| Show InChI InChI=1S/C19H24N4/c20-12-11-17-13-21-19(22-17)15-23(18-9-5-2-6-10-18)14-16-7-3-1-4-8-16/h1-10,17H,11-15,20H2,(H,21,22)/t17-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.16E+4	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50256484 ((R)-2-(4,5-dihydro-1H-imidazol-5-yl)ethanamine dih...) Show SMILES NCC[C@@H]1CNC=N1 |r,c:6| Show InChI InChI=1S/C5H11N3/c6-2-1-5-3-7-4-8-5/h4-5H,1-3,6H2,(H,7,8)/t5-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.65E+4	n/a	n/a	n/a	n/a	n/a	n/a
Gda£?sk University of Technology Curated by ChEMBL					Assay Description Displacement of [3H]clonidine from imidazoline I1 receptor in Sprague-Dawley rat kidney by liquid scintillation counting				Bioorg Med Chem Lett 19: 1009-11 (2009) Article DOI: 10.1016/j.bmcl.2008.11.055 BindingDB Entry DOI: 10.7270/Q2125SJ6
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334564 (CHEMBL1644520 | [4(5)S]-4(5)-(2-Aminoethyl)-2-[(E)...) Show SMILES NCC[C@H]1CN=C(N1)C=Cc1ccccc1 |r,w:8.8,c:5| Show InChI InChI=1S/C13H17N3/c14-9-8-12-10-15-13(16-12)7-6-11-4-2-1-3-5-11/h1-7,12H,8-10,14H2,(H,15,16)/t12-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.72E+4	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334558 (CHEMBL1644514 | [4(5)R]-4(5)-(2-Aminoethyl)-2-(2-e...) Show SMILES CCC1(Cc2ccccc2O1)C1=NC[C@@H](CCN)N1 |r,t:13| Show InChI InChI=1S/C15H21N3O/c1-2-15(14-17-10-12(18-14)7-8-16)9-11-5-3-4-6-13(11)19-15/h3-6,12H,2,7-10,16H2,1H3,(H,17,18)/t12-,15?/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334543 ((S)-4-(2-aminoethyl)-N-(3-chlorophenyl)-4,5-dihydr...) Show SMILES NCC[C@H]1CN=C(Nc2cccc(Cl)c2)N1 |r,t:5| Show InChI InChI=1S/C11H15ClN4/c12-8-2-1-3-9(6-8)15-11-14-7-10(16-11)4-5-13/h1-3,6,10H,4-5,7,13H2,(H2,14,15,16)/t10-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.39E+4	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM85213 (Agmatine | CAS_306-60-5 | CHEMBL58343 | NSC_199 | ...) Show SMILES [#7]-[#6]-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7] Show InChI InChI=1S/C5H14N4/c6-3-1-2-4-9-5(7)8/h1-4,6H2,(H4,7,8,9)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.65E+4	n/a	n/a	n/a	n/a	n/a	n/a
Gda£?sk University of Technology Curated by ChEMBL					Assay Description Displacement of [3H]clonidine from imidazoline I1 receptor in Wistar rat kidney by liquid scintillation counting				Bioorg Med Chem Lett 19: 1009-11 (2009) Article DOI: 10.1016/j.bmcl.2008.11.055 BindingDB Entry DOI: 10.7270/Q2125SJ6
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM85213 (Agmatine | CAS_306-60-5 | CHEMBL58343 | NSC_199 | ...) Show SMILES [#7]-[#6]-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7] Show InChI InChI=1S/C5H14N4/c6-3-1-2-4-9-5(7)8/h1-4,6H2,(H4,7,8,9)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.65E+4	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Wistar rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50256541 ((S)-5-(2-(dimethylamino)ethyl)-4,5-dihydro-1H-imid...) Show SMILES CN(C)CC[C@H]1CNC(N)=N1 |r,c:9| Show InChI InChI=1S/C7H16N4/c1-11(2)4-3-6-5-9-7(8)10-6/h6H,3-5H2,1-2H3,(H3,8,9,10)/t6-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.49E+4	n/a	n/a	n/a	n/a	n/a	n/a
Gda£?sk University of Technology Curated by ChEMBL					Assay Description Displacement of [3H]clonidine from imidazoline I1 receptor in Sprague-Dawley rat kidney by liquid scintillation counting				Bioorg Med Chem Lett 19: 1009-11 (2009) Article DOI: 10.1016/j.bmcl.2008.11.055 BindingDB Entry DOI: 10.7270/Q2125SJ6
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334541 ((S)-4-(2-aminoethyl)-N-(4-bromophenyl)-4,5-dihydro...) Show SMILES NCC[C@H]1CN=C(Nc2ccc(Br)cc2)N1 |r,t:5| Show InChI InChI=1S/C11H15BrN4/c12-8-1-3-9(4-2-8)15-11-14-7-10(16-11)5-6-13/h1-4,10H,5-7,13H2,(H2,14,15,16)/t10-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.94E+4	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50256542 ((S)-2-(4,5-dihydro-1H-imidazol-5-yl)-N,N-dimethyle...) Show SMILES CN(C)CC[C@H]1CNC=N1 |r,c:8| Show InChI InChI=1S/C7H15N3/c1-10(2)4-3-7-5-8-6-9-7/h6-7H,3-5H2,1-2H3,(H,8,9)/t7-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Gda£?sk University of Technology Curated by ChEMBL					Assay Description Displacement of [3H]clonidine from imidazoline I1 receptor in Sprague-Dawley rat kidney by liquid scintillation counting				Bioorg Med Chem Lett 19: 1009-11 (2009) Article DOI: 10.1016/j.bmcl.2008.11.055 BindingDB Entry DOI: 10.7270/Q2125SJ6
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334562 (CHEMBL1644518 | [4(5)S]-4(5)-(2-Aminoethyl)-2-phen...) Show SMILES NCC[C@H]1CN=C(N1)c1ccccc1 |r,c:5| Show InChI InChI=1S/C11H15N3/c12-7-6-10-8-13-11(14-10)9-4-2-1-3-5-9/h1-5,10H,6-8,12H2,(H,13,14)/t10-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.29E+4	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334542 ((S)-4-(2-aminoethyl)-N-(4-methoxyphenyl)-4,5-dihyd...) Show SMILES COc1ccc(NC2=NC[C@H](CCN)N2)cc1 |r,t:7| Show InChI InChI=1S/C12H18N4O/c1-17-11-4-2-9(3-5-11)15-12-14-8-10(16-12)6-7-13/h2-5,10H,6-8,13H2,1H3,(H2,14,15,16)/t10-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.98E+4	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334540 ((S)-4-(2-aminoethyl)-N-(2,6-difluorophenyl)-4,5-di...) Show SMILES NCC[C@H]1CNC(N1)=Nc1c(F)cccc1F |r,w:8.9| Show InChI InChI=1S/C11H14F2N4/c12-8-2-1-3-9(13)10(8)17-11-15-6-7(16-11)4-5-14/h1-3,7H,4-6,14H2,(H2,15,16,17)/t7-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.31E+4	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50256482 ((R)-5-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-ami...) Show SMILES NCC[C@@H]1CNC(N)=N1 |r,c:7| Show InChI InChI=1S/C5H12N4/c6-2-1-4-3-8-5(7)9-4/h4H,1-3,6H2,(H3,7,8,9)/t4-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Gda£?sk University of Technology Curated by ChEMBL					Assay Description Displacement of [3H]clonidine from imidazoline I1 receptor in Sprague-Dawley rat kidney by liquid scintillation counting				Bioorg Med Chem Lett 19: 1009-11 (2009) Article DOI: 10.1016/j.bmcl.2008.11.055 BindingDB Entry DOI: 10.7270/Q2125SJ6
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50256483 ((S)-2-(4,5-dihydro-1H-imidazol-5-yl)ethanamine dih...) Show SMILES NCC[C@H]1CNC=N1 |r,c:6| Show InChI InChI=1S/C5H11N3/c6-2-1-5-3-7-4-8-5/h4-5H,1-3,6H2,(H,7,8)/t5-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Gda£?sk University of Technology Curated by ChEMBL					Assay Description Displacement of [3H]clonidine from imidazoline I1 receptor in Sprague-Dawley rat kidney by liquid scintillation counting				Bioorg Med Chem Lett 19: 1009-11 (2009) Article DOI: 10.1016/j.bmcl.2008.11.055 BindingDB Entry DOI: 10.7270/Q2125SJ6
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334555 (CHEMBL1644511 | [4(5)S]-4(5)-(2-Aminoethyl)-2-[(na...) Show SMILES NCC[C@H]1CN=C(Cc2cccc3ccccc23)N1 |r,t:5| Show InChI InChI=1S/C16H19N3/c17-9-8-14-11-18-16(19-14)10-13-6-3-5-12-4-1-2-7-15(12)13/h1-7,14H,8-11,17H2,(H,18,19)/t14-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334553 (CHEMBL1644509 | [4(5)S]-4(5)-(2-Aminoethyl)-2-[(di...) Show SMILES NCC[C@H]1CN=C(NC(C2CC2)C2CC2)N1 |r,t:5| Show InChI InChI=1S/C12H22N4/c13-6-5-10-7-14-12(15-10)16-11(8-1-2-8)9-3-4-9/h8-11H,1-7,13H2,(H2,14,15,16)/t10-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334538 (CHEMBL1644495 | [4(5)S]-2-Benzylamino-4(5)-(2-amin...) Show SMILES NCC[C@H]1CN=C(NCc2ccccc2)N1 |r,t:5| Show InChI InChI=1S/C12H18N4/c13-7-6-11-9-15-12(16-11)14-8-10-4-2-1-3-5-10/h1-5,11H,6-9,13H2,(H2,14,15,16)/t11-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.01E+5	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50256485 ((S)-2-(2-methyl-4,5-dihydro-1H-imidazol-5-yl)ethan...) Show SMILES CC1=N[C@@H](CCN)CN1 |r,t:1| Show InChI InChI=1S/C6H13N3/c1-5-8-4-6(9-5)2-3-7/h6H,2-4,7H2,1H3,(H,8,9)/t6-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.15E+5	n/a	n/a	n/a	n/a	n/a	n/a
Gda£?sk University of Technology Curated by ChEMBL					Assay Description Displacement of [3H]clonidine from imidazoline I1 receptor in Sprague-Dawley rat kidney by liquid scintillation counting				Bioorg Med Chem Lett 19: 1009-11 (2009) Article DOI: 10.1016/j.bmcl.2008.11.055 BindingDB Entry DOI: 10.7270/Q2125SJ6
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50334563 (CHEMBL1644519 | [4(5)S]-4(5)-(2-Aminoethyl)-2-(2-f...) Show SMILES NCC[C@H]1CN=C(N1)c1ccccc1F |r,c:5| Show InChI InChI=1S/C11H14FN3/c12-10-4-2-1-3-9(10)11-14-7-8(15-11)5-6-13/h1-4,8H,5-7,13H2,(H,14,15)/t8-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.17E+5	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair
Nischarin (RAT)	BDBM50256540 ((S)-N-(2-(4,5-dihydro-1H-imidazol-5-yl)ethyl)aceta...) Show SMILES CC(=O)NCC[C@H]1CNC=N1 |r,c:9| Show InChI InChI=1S/C7H13N3O/c1-6(11)9-3-2-7-4-8-5-10-7/h5,7H,2-4H2,1H3,(H,8,10)(H,9,11)/t7-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.13E+5	n/a	n/a	n/a	n/a	n/a	n/a
Gda£?sk University of Technology Curated by ChEMBL					Assay Description Displacement of [3H]clonidine from imidazoline I1 receptor in Sprague-Dawley rat kidney by liquid scintillation counting				Bioorg Med Chem Lett 19: 1009-11 (2009) Article DOI: 10.1016/j.bmcl.2008.11.055 BindingDB Entry DOI: 10.7270/Q2125SJ6
					More data for this Ligand-Target Pair

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