Compile Data Set for Download or QSAR

Found 28 hits with Last Name = 'murahari' and Initial = 'm'   

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
ATP-dependent translocase ABCB1 (Homo sapiens (Human))	BDBM50238974 (CHEMBL4085670) Show SMILES Cc1cc(C)c2n(CCCCN3CCN(CCO)CC3)c3ccccc3c(=O)c2c1 Show InChI InChI=1S/C25H33N3O2/c1-19-17-20(2)24-22(18-19)25(30)21-7-3-4-8-23(21)28(24)10-6-5-9-26-11-13-27(14-12-26)15-16-29/h3-4,7-8,17-18,29H,5-6,9-16H2,1-2H3	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.30	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of ABCB1 in human MCF7/ADR cells assessed as potentiation of vinblastine-induced cytotoxicity by measuring vinblastine IC50 at IC10 after ...				Eur J Med Chem 130: 154-170 (2017) Article DOI: 10.1016/j.ejmech.2017.02.022 BindingDB Entry DOI: 10.7270/Q26D5W99
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50278034 (CHEMBL4169791) Show SMILES CCOC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccc(OC)cc1 Show InChI InChI=1S/C29H25N5O5/c1-4-39-28(37)23-16(2)30-29(32-24(23)17-12-14-18(38-3)15-13-17)34-33-27(36)21-10-7-9-20-25(21)31-22-11-6-5-8-19(22)26(20)35/h5-15H,4H2,1-3H3,(H,31,35)(H,33,36)(H,30,32,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of PH domain lacking AKT1 (unknown origin) using Tamara-labeled GRPRTSSFAEG peptide as substrate after 90 mins by fluorescence polarizatio...				Eur J Med Chem 139: 961-981 (2017) Article DOI: 10.1016/j.ejmech.2017.08.023 BindingDB Entry DOI: 10.7270/Q2668GQS
					More data for this Ligand-Target Pair
ATP-dependent translocase ABCB1 (Homo sapiens (Human))	BDBM50238973 (CHEMBL4064097) Show SMILES Cc1cc(C)c2n(CCCCN(CCO)CCO)c3ccccc3c(=O)c2c1 Show InChI InChI=1S/C23H30N2O3/c1-17-15-18(2)22-20(16-17)23(28)19-7-3-4-8-21(19)25(22)10-6-5-9-24(11-13-26)12-14-27/h3-4,7-8,15-16,26-27H,5-6,9-14H2,1-2H3	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.10	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description In vitro inhibitory activity against human plasma renin				Eur J Med Chem 130: 154-170 (2017) Article DOI: 10.1016/j.ejmech.2017.02.022 BindingDB Entry DOI: 10.7270/Q26D5W99
					More data for this Ligand-Target Pair
ATP-dependent translocase ABCB1 (Homo sapiens (Human))	BDBM50238970 (CHEMBL4094336) Show SMILES Cc1cc(C)c2n(CCCCN3CCOCC3)c3ccccc3c(=O)c2c1 Show InChI InChI=1S/C23H28N2O2/c1-17-15-18(2)22-20(16-17)23(26)19-7-3-4-8-21(19)25(22)10-6-5-9-24-11-13-27-14-12-24/h3-4,7-8,15-16H,5-6,9-14H2,1-2H3	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of ABCB1 in human MCF7/ADR cells assessed as potentiation of vinblastine-induced cytotoxicity by measuring vinblastine IC50 at IC10 after ...				Eur J Med Chem 130: 154-170 (2017) Article DOI: 10.1016/j.ejmech.2017.02.022 BindingDB Entry DOI: 10.7270/Q26D5W99
					More data for this Ligand-Target Pair
ATP-dependent translocase ABCB1 (Homo sapiens (Human))	BDBM50238972 (CHEMBL4077817) Show SMILES CCN(CC)CCCCn1c2ccccc2c(=O)c2cc(C)cc(C)c12 Show InChI InChI=1S/C23H30N2O/c1-5-24(6-2)13-9-10-14-25-21-12-8-7-11-19(21)23(26)20-16-17(3)15-18(4)22(20)25/h7-8,11-12,15-16H,5-6,9-10,13-14H2,1-4H3	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	4.10	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description In vitro inhibitory activity against man (human) plasma renin				Eur J Med Chem 130: 154-170 (2017) Article DOI: 10.1016/j.ejmech.2017.02.022 BindingDB Entry DOI: 10.7270/Q26D5W99
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50278056 (CHEMBL4163627) Show SMILES CCOC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccccc1 Show InChI InChI=1S/C28H23N5O4/c1-3-37-27(36)22-16(2)29-28(31-23(22)17-10-5-4-6-11-17)33-32-26(35)20-14-9-13-19-24(20)30-21-15-8-7-12-18(21)25(19)34/h4-15H,3H2,1-2H3,(H,30,34)(H,32,35)(H,29,31,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.70	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Antagonistic affinity against Alpha-1A adrenergic receptor was determined in isolated prostatic vas deferens tissue from rat				Eur J Med Chem 139: 961-981 (2017) Article DOI: 10.1016/j.ejmech.2017.08.023 BindingDB Entry DOI: 10.7270/Q2668GQS
					More data for this Ligand-Target Pair
ATP-dependent translocase ABCB1 (Homo sapiens (Human))	BDBM50238971 (CHEMBL4066830) Show SMILES Cc1cc(C)c2n(CCCCN3CCCCC3)c3ccccc3c(=O)c2c1 Show InChI InChI=1S/C24H30N2O/c1-18-16-19(2)23-21(17-18)24(27)20-10-4-5-11-22(20)26(23)15-9-8-14-25-12-6-3-7-13-25/h4-5,10-11,16-17H,3,6-9,12-15H2,1-2H3	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of ABCB1 in human MCF7/ADR cells assessed as potentiation of vinblastine-induced cytotoxicity by measuring vinblastine IC50 at IC10 after ...				Eur J Med Chem 130: 154-170 (2017) Article DOI: 10.1016/j.ejmech.2017.02.022 BindingDB Entry DOI: 10.7270/Q26D5W99
					More data for this Ligand-Target Pair
ATP-dependent translocase ABCB1 (Homo sapiens (Human))	BDBM50238979 (CHEMBL4086583) Show SMILES Cc1cc(C)c2n(CCCN3CCN(CCO)CC3)c3ccccc3c(=O)c2c1 Show InChI InChI=1S/C24H31N3O2/c1-18-16-19(2)23-21(17-18)24(29)20-6-3-4-7-22(20)27(23)9-5-8-25-10-12-26(13-11-25)14-15-28/h3-4,6-7,16-17,28H,5,8-15H2,1-2H3	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description In vitro inhibitory activity against human plasma renin				Eur J Med Chem 130: 154-170 (2017) Article DOI: 10.1016/j.ejmech.2017.02.022 BindingDB Entry DOI: 10.7270/Q26D5W99
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50278048 (CHEMBL4160193) Show SMILES CCOC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccccc1F Show InChI InChI=1S/C28H22FN5O4/c1-3-38-27(37)22-15(2)30-28(32-24(22)16-9-4-6-13-20(16)29)34-33-26(36)19-12-8-11-18-23(19)31-21-14-7-5-10-17(21)25(18)35/h4-14H,3H2,1-2H3,(H,31,35)(H,33,36)(H,30,32,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.20	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Antagonistic affinity against Alpha-1B adrenergic receptor was determined in isolated spleen tissue from rat				Eur J Med Chem 139: 961-981 (2017) Article DOI: 10.1016/j.ejmech.2017.08.023 BindingDB Entry DOI: 10.7270/Q2668GQS
					More data for this Ligand-Target Pair
ATP-dependent translocase ABCB1 (Homo sapiens (Human))	BDBM50238980 (CHEMBL4102080) Show SMILES CN1CCN(CCCCn2c3ccccc3c(=O)c3cc(C)cc(C)c23)CC1 Show InChI InChI=1S/C24H31N3O/c1-18-16-19(2)23-21(17-18)24(28)20-8-4-5-9-22(20)27(23)11-7-6-10-26-14-12-25(3)13-15-26/h4-5,8-9,16-17H,6-7,10-15H2,1-3H3	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description In vitro inhibitory activity against human plasma renin				Eur J Med Chem 130: 154-170 (2017) Article DOI: 10.1016/j.ejmech.2017.02.022 BindingDB Entry DOI: 10.7270/Q26D5W99
					More data for this Ligand-Target Pair
ATP-dependent translocase ABCB1 (Homo sapiens (Human))	BDBM50238969 (CHEMBL4096764) Show SMILES Cc1cc(C)c2n(CCCN(CCO)CCO)c3ccccc3c(=O)c2c1 Show InChI InChI=1S/C22H28N2O3/c1-16-14-17(2)21-19(15-16)22(27)18-6-3-4-7-20(18)24(21)9-5-8-23(10-12-25)11-13-26/h3-4,6-7,14-15,25-26H,5,8-13H2,1-2H3	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of ABCB1 in human MCF7/ADR cells assessed as potentiation of vinblastine-induced cytotoxicity by measuring vinblastine IC50 at IC10 after ...				Eur J Med Chem 130: 154-170 (2017) Article DOI: 10.1016/j.ejmech.2017.02.022 BindingDB Entry DOI: 10.7270/Q26D5W99
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50278044 (CHEMBL4173126) Show SMILES CCOC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1CC(C)C Show InChI InChI=1S/C26H27N5O4/c1-5-35-25(34)21-15(4)27-26(29-20(21)13-14(2)3)31-30-24(33)18-11-8-10-17-22(18)28-19-12-7-6-9-16(19)23(17)32/h6-12,14H,5,13H2,1-4H3,(H,28,32)(H,30,33)(H,27,29,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Antagonistic affinity against Alpha-1D adrenergic receptor was determined in isolated thoracic aorta from rat				Eur J Med Chem 139: 961-981 (2017) Article DOI: 10.1016/j.ejmech.2017.08.023 BindingDB Entry DOI: 10.7270/Q2668GQS
					More data for this Ligand-Target Pair
ATP-dependent translocase ABCB1 (Homo sapiens (Human))	BDBM50238968 (CHEMBL4078738) Show SMILES CCN(CC)CCCn1c2ccccc2c(=O)c2cc(C)cc(C)c12 Show InChI InChI=1S/C22H28N2O/c1-5-23(6-2)12-9-13-24-20-11-8-7-10-18(20)22(25)19-15-16(3)14-17(4)21(19)24/h7-8,10-11,14-15H,5-6,9,12-13H2,1-4H3	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description In vitro inhibitory activity against human plasma renin				Eur J Med Chem 130: 154-170 (2017) Article DOI: 10.1016/j.ejmech.2017.02.022 BindingDB Entry DOI: 10.7270/Q26D5W99
					More data for this Ligand-Target Pair
ATP-dependent translocase ABCB1 (Homo sapiens (Human))	BDBM50238977 (CHEMBL4073625) Show SMILES CN1CCN(CCCn2c3ccccc3c(=O)c3cc(C)cc(C)c23)CC1 Show InChI InChI=1S/C23H29N3O/c1-17-15-18(2)22-20(16-17)23(27)19-7-4-5-8-21(19)26(22)10-6-9-25-13-11-24(3)12-14-25/h4-5,7-8,15-16H,6,9-14H2,1-3H3	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of ABCB1 in human MCF7/ADR cells assessed as potentiation of vinblastine-induced cytotoxicity by measuring vinblastine IC50 at IC10 after ...				Eur J Med Chem 130: 154-170 (2017) Article DOI: 10.1016/j.ejmech.2017.02.022 BindingDB Entry DOI: 10.7270/Q26D5W99
					More data for this Ligand-Target Pair
ATP-dependent translocase ABCB1 (Homo sapiens (Human))	BDBM50238978 (CHEMBL4094253) Show SMILES Cc1cc(C)c2n(CCCN3CCCCC3)c3ccccc3c(=O)c2c1 Show InChI InChI=1S/C23H28N2O/c1-17-15-18(2)22-20(16-17)23(26)19-9-4-5-10-21(19)25(22)14-8-13-24-11-6-3-7-12-24/h4-5,9-10,15-16H,3,6-8,11-14H2,1-2H3	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of dog plasma renin activity				Eur J Med Chem 130: 154-170 (2017) Article DOI: 10.1016/j.ejmech.2017.02.022 BindingDB Entry DOI: 10.7270/Q26D5W99
					More data for this Ligand-Target Pair
ATP-dependent translocase ABCB1 (Homo sapiens (Human))	BDBM50238976 (CHEMBL4099509) Show SMILES Cc1cc(C)c2n(CCCN3CCOCC3)c3ccccc3c(=O)c2c1 Show InChI InChI=1S/C22H26N2O2/c1-16-14-17(2)21-19(15-16)22(25)18-6-3-4-7-20(18)24(21)9-5-8-23-10-12-26-13-11-23/h3-4,6-7,14-15H,5,8-13H2,1-2H3	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of ABCB1 in human MCF7/ADR cells assessed as potentiation of vinblastine-induced cytotoxicity by measuring vinblastine IC50 at IC10 after ...				Eur J Med Chem 130: 154-170 (2017) Article DOI: 10.1016/j.ejmech.2017.02.022 BindingDB Entry DOI: 10.7270/Q26D5W99
					More data for this Ligand-Target Pair
ATP-dependent translocase ABCB1 (Homo sapiens (Human))	BDBM50238975 (CHEMBL4091769) Show SMILES Cc1cc(C)c2[nH]c3ccccc3c(=O)c2c1 Show InChI InChI=1S/C15H13NO/c1-9-7-10(2)14-12(8-9)15(17)11-5-3-4-6-13(11)16-14/h3-8H,1-2H3,(H,16,17)	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of ABCB1 in human MCF7/ADR cells assessed as potentiation of vinblastine-induced cytotoxicity by measuring vinblastine IC50 at IC10 after ...				Eur J Med Chem 130: 154-170 (2017) Article DOI: 10.1016/j.ejmech.2017.02.022 BindingDB Entry DOI: 10.7270/Q26D5W99
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50278019 (CHEMBL4172716) Show SMILES COC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccccc1 Show InChI InChI=1S/C27H21N5O4/c1-15-21(26(35)36-2)22(16-9-4-3-5-10-16)30-27(28-15)32-31-25(34)19-13-8-12-18-23(19)29-20-14-7-6-11-17(20)24(18)33/h3-14H,1-2H3,(H,29,33)(H,31,34)(H,28,30,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	56	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of PH domain lacking AKT1 (unknown origin) using Tamara-labeled GRPRTSSFAEG peptide as substrate after 90 mins by fluorescence polarizatio...				Eur J Med Chem 139: 961-981 (2017) Article DOI: 10.1016/j.ejmech.2017.08.023 BindingDB Entry DOI: 10.7270/Q2668GQS
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50278035 (CHEMBL4171390) Show SMILES CCOC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccc(OC)c(OC)c1 Show InChI InChI=1S/C30H27N5O6/c1-5-41-29(38)24-16(2)31-30(33-25(24)17-13-14-22(39-3)23(15-17)40-4)35-34-28(37)20-11-8-10-19-26(20)32-21-12-7-6-9-18(21)27(19)36/h6-15H,5H2,1-4H3,(H,32,36)(H,34,37)(H,31,33,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	115	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of PH domain lacking AKT1 (unknown origin) using Tamara-labeled GRPRTSSFAEG peptide as substrate after 90 mins by fluorescence polarizatio...				Eur J Med Chem 139: 961-981 (2017) Article DOI: 10.1016/j.ejmech.2017.08.023 BindingDB Entry DOI: 10.7270/Q2668GQS
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50278033 (CHEMBL4159491) Show SMILES CCOC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccc(F)cc1 Show InChI InChI=1S/C28H22FN5O4/c1-3-38-27(37)22-15(2)30-28(32-23(22)16-11-13-17(29)14-12-16)34-33-26(36)20-9-6-8-19-24(20)31-21-10-5-4-7-18(21)25(19)35/h4-14H,3H2,1-2H3,(H,31,35)(H,33,36)(H,30,32,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	176	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of PH domain lacking AKT1 (unknown origin) using Tamara-labeled GRPRTSSFAEG peptide as substrate after 90 mins by fluorescence polarizatio...				Eur J Med Chem 139: 961-981 (2017) Article DOI: 10.1016/j.ejmech.2017.08.023 BindingDB Entry DOI: 10.7270/Q2668GQS
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50278031 (CHEMBL4163164) Show SMILES CCOC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1cccc(OC)c1 Show InChI InChI=1S/C29H25N5O5/c1-4-39-28(37)23-16(2)30-29(32-24(23)17-9-7-10-18(15-17)38-3)34-33-27(36)21-13-8-12-20-25(21)31-22-14-6-5-11-19(22)26(20)35/h5-15H,4H2,1-3H3,(H,31,35)(H,33,36)(H,30,32,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	251	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Antagonistic potency for NK-3 receptor was determined in vitro, using isolated rat portal vein.				Eur J Med Chem 139: 961-981 (2017) Article DOI: 10.1016/j.ejmech.2017.08.023 BindingDB Entry DOI: 10.7270/Q2668GQS
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50278047 (CHEMBL4160580) Show SMILES COC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccc(OC)c(OC)c1 Show InChI InChI=1S/C29H25N5O6/c1-15-23(28(37)40-4)24(16-12-13-21(38-2)22(14-16)39-3)32-29(30-15)34-33-27(36)19-10-7-9-18-25(19)31-20-11-6-5-8-17(20)26(18)35/h5-14H,1-4H3,(H,31,35)(H,33,36)(H,30,32,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	311	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Antagonistic affinity against Alpha-1A adrenergic receptor was determined in isolated prostatic vas deferens tissue from rat				Eur J Med Chem 139: 961-981 (2017) Article DOI: 10.1016/j.ejmech.2017.08.023 BindingDB Entry DOI: 10.7270/Q2668GQS
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50278032 (CHEMBL4169321) Show SMILES COC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccc(F)cc1 Show InChI InChI=1S/C27H20FN5O4/c1-14-21(26(36)37-2)22(15-10-12-16(28)13-11-15)31-27(29-14)33-32-25(35)19-8-5-7-18-23(19)30-20-9-4-3-6-17(20)24(18)34/h3-13H,1-2H3,(H,30,34)(H,32,35)(H,29,31,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	313	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Antagonistic potency for NK-1 receptor was determined in vitro,using isolated rabbit vena cava.				Eur J Med Chem 139: 961-981 (2017) Article DOI: 10.1016/j.ejmech.2017.08.023 BindingDB Entry DOI: 10.7270/Q2668GQS
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50278057 (CHEMBL4164809) Show SMILES COC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccccc1F Show InChI InChI=1S/C27H20FN5O4/c1-14-21(26(36)37-2)23(15-8-3-5-12-19(15)28)31-27(29-14)33-32-25(35)18-11-7-10-17-22(18)30-20-13-6-4-9-16(20)24(17)34/h3-13H,1-2H3,(H,30,34)(H,32,35)(H,29,31,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	432	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Antagonistic affinity against Alpha-1A adrenergic receptor was determined in isolated prostatic vas deferens tissue from rat				Eur J Med Chem 139: 961-981 (2017) Article DOI: 10.1016/j.ejmech.2017.08.023 BindingDB Entry DOI: 10.7270/Q2668GQS
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50278046 (CHEMBL4170874) Show SMILES COC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1cccc(OC)c1 Show InChI InChI=1S/C28H23N5O5/c1-15-22(27(36)38-3)23(16-8-6-9-17(14-16)37-2)31-28(29-15)33-32-26(35)20-12-7-11-19-24(20)30-21-13-5-4-10-18(21)25(19)34/h4-14H,1-3H3,(H,30,34)(H,32,35)(H,29,31,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	482	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Antagonistic affinity against Alpha-1B adrenergic receptor was determined in isolated spleen tissue from rat				Eur J Med Chem 139: 961-981 (2017) Article DOI: 10.1016/j.ejmech.2017.08.023 BindingDB Entry DOI: 10.7270/Q2668GQS
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50278045 (CHEMBL4161394) Show SMILES COC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccc(OC)cc1 Show InChI InChI=1S/C28H23N5O5/c1-15-22(27(36)38-3)23(16-11-13-17(37-2)14-12-16)31-28(29-15)33-32-26(35)20-9-6-8-19-24(20)30-21-10-5-4-7-18(21)25(19)34/h4-14H,1-3H3,(H,30,34)(H,32,35)(H,29,31,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	640	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Antagonistic affinity against Alpha-1A adrenergic receptor was determined in isolated prostatic vas deferens tissue from rat				Eur J Med Chem 139: 961-981 (2017) Article DOI: 10.1016/j.ejmech.2017.08.023 BindingDB Entry DOI: 10.7270/Q2668GQS
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50278030 (CHEMBL4176130) Show SMILES COC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccc(C)cc1 Show InChI InChI=1S/C28H23N5O4/c1-15-11-13-17(14-12-15)23-22(27(36)37-3)16(2)29-28(31-23)33-32-26(35)20-9-6-8-19-24(20)30-21-10-5-4-7-18(21)25(19)34/h4-14H,1-3H3,(H,30,34)(H,32,35)(H,29,31,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	738	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Antagonistic potency for NK-3 receptor was determined in vitro, using isolated rat portal vein.				Eur J Med Chem 139: 961-981 (2017) Article DOI: 10.1016/j.ejmech.2017.08.023 BindingDB Entry DOI: 10.7270/Q2668GQS
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50278043 (CHEMBL4161273) Show SMILES CCOC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccc(C)cc1 Show InChI InChI=1S/C29H25N5O4/c1-4-38-28(37)23-17(3)30-29(32-24(23)18-14-12-16(2)13-15-18)34-33-27(36)21-10-7-9-20-25(21)31-22-11-6-5-8-19(22)26(20)35/h5-15H,4H2,1-3H3,(H,31,35)(H,33,36)(H,30,32,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	980	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Compound was evaluated for in vitro inhibition of human immunodeficiency virus type 1 (HIV-1) Protease				Eur J Med Chem 139: 961-981 (2017) Article DOI: 10.1016/j.ejmech.2017.08.023 BindingDB Entry DOI: 10.7270/Q2668GQS
					More data for this Ligand-Target Pair