Compile Data Set for Download or QSAR

Found 56 hits with Last Name = 'tizot' and Initial = 'a'   

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
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053877 (Allyl-(9-allyl-2-{4-[2,2-bis-(4-fluoro-phenyl)-eth...) Show SMILES Fc1ccc(cc1)C(CNC1CCN(CC1)c1nc(NCC=C)c2ncn(CC=C)c2n1)c1ccc(F)cc1 Show InChI InChI=1S/C30H33F2N7/c1-3-15-33-28-27-29(39(16-4-2)20-35-27)37-30(36-28)38-17-13-25(14-18-38)34-19-26(21-5-9-23(31)10-6-21)22-7-11-24(32)12-8-22/h3-12,20,25-26,34H,1-2,13-19H2,(H,33,36,37)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053873 (Allyl-(9-allyl-2-{4-[(2-methoxy-10,11-dihydro-5H-d...) Show SMILES COc1ccc2C(CNC3CCN(CC3)c3nc(NCC=C)c4ncn(CC=C)c4n3)c3ccccc3CCc2c1 Show InChI InChI=1S/C33H39N7O/c1-4-16-34-31-30-32(40(17-5-2)22-36-30)38-33(37-31)39-18-14-25(15-19-39)35-21-29-27-9-7-6-8-23(27)10-11-24-20-26(41-3)12-13-28(24)29/h4-9,12-13,20,22,25,29,35H,1-2,10-11,14-19,21H2,3H3,(H,34,37,38)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053900 (Allyl-(9-allyl-2-{4-[(10,11-dihydro-5H-dibenzo[a,d...) Show SMILES C=CCNc1nc(nc2n(CC=C)cnc12)N1CCC(CC1)NCC1Cc2ccccc2Cc2ccccc12 Show InChI InChI=1S/C32H37N7/c1-3-15-33-30-29-31(39(16-4-2)22-35-29)37-32(36-30)38-17-13-27(14-18-38)34-21-26-20-24-10-6-5-9-23(24)19-25-11-7-8-12-28(25)26/h3-12,22,26-27,34H,1-2,13-21H2,(H,33,36,37)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	46	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053872 (Allyl-(2-{4-[(10,11-dihydro-5H-dibenzo[a,d]cyclohe...) Show SMILES CCCn1cnc2c(NCC=C)nc(nc12)N1CCC(CC1)NCC1c2ccccc2CCc2ccccc12 Show InChI InChI=1S/C32H39N7/c1-3-17-33-30-29-31(39(18-4-2)22-35-29)37-32(36-30)38-19-15-25(16-20-38)34-21-28-26-11-7-5-9-23(26)13-14-24-10-6-8-12-27(24)28/h3,5-12,22,25,28,34H,1,4,13-21H2,2H3,(H,33,36,37)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	48	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM81939 (CAS_52-53-9 | NSC_62969 | VERAPAMIL) Show SMILES COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC Show InChI InChI=1S/C27H38N2O4/c1-20(2)27(19-28,22-10-12-24(31-5)26(18-22)33-7)14-8-15-29(3)16-13-21-9-11-23(30-4)25(17-21)32-6/h9-12,17-18,20H,8,13-16H2,1-7H3	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase DrugBank MCE KEGG PC cid PC sid PDB UniChem Similars	PDB Article PubMed	58	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair				3D Structure (crystal)
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053892 (Allyl-(9-allyl-2-{4-[(6,7,8,9-tetrahydro-5H-benzoc...) Show SMILES C=CCNc1nc(nc2n(CC=C)cnc12)N1CCC(CC1)NCC1CCCCc2ccccc12 Show InChI InChI=1S/C28H37N7/c1-3-15-29-26-25-27(35(16-4-2)20-31-25)33-28(32-26)34-17-13-23(14-18-34)30-19-22-11-6-5-9-21-10-7-8-12-24(21)22/h3-4,7-8,10,12,20,22-23,30H,1-2,5-6,9,11,13-19H2,(H,29,32,33)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	62	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053880 (Allyl-(9-allyl-6-{4-[(10,11-dihydro-5H-dibenzo[a,d...) Show SMILES C=CCNc1nc(N2CCC(CC2)NCC2c3ccccc3CCc3ccccc23)c2ncn(CC=C)c2n1 Show InChI InChI=1S/C32H37N7/c1-3-17-33-32-36-30(29-31(37-32)39(18-4-2)22-35-29)38-19-15-25(16-20-38)34-21-28-26-11-7-5-9-23(26)13-14-24-10-6-8-12-27(24)28/h3-12,22,25,28,34H,1-2,13-21H2,(H,33,36,37)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	62	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053891 ((9-Allyl-2-{4-[(10,11-dihydro-5H-dibenzo[a,d]cyclo...) Show SMILES CCCNc1nc(nc2n(CC=C)cnc12)N1CCC(CC1)NCC1c2ccccc2CCc2ccccc12 Show InChI InChI=1S/C32H39N7/c1-3-17-33-30-29-31(39(18-4-2)22-35-29)37-32(36-30)38-19-15-25(16-20-38)34-21-28-26-11-7-5-9-23(26)13-14-24-10-6-8-12-27(24)28/h4-12,22,25,28,34H,2-3,13-21H2,1H3,(H,33,36,37)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	84	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053885 (Allyl-(9-allyl-2-{4-[(8-chloro-11-methyl-10,10-dio...) Show SMILES CN1c2ccccc2C(CNC2CCN(CC2)c2nc(NCC=C)c3ncn(CC=C)c3n2)c2ccc(Cl)cc2S1(=O)=O Show InChI InChI=1S/C31H35ClN8O2S/c1-4-14-33-29-28-30(40(15-5-2)20-35-28)37-31(36-29)39-16-12-22(13-17-39)34-19-25-23-8-6-7-9-26(23)38(3)43(41,42)27-18-21(32)10-11-24(25)27/h4-11,18,20,22,25,34H,1-2,12-17,19H2,3H3,(H,33,36,37)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	87	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053888 (CHEMBL85156 | N,N'-Diallyl-6-{4-[2,2-bis-(4-fluoro...) Show SMILES Fc1ccc(cc1)C(CNC1CCN(CC1)c1nc(NCC=C)nc(NCC=C)n1)c1ccc(F)cc1 Show InChI InChI=1S/C28H33F2N7/c1-3-15-31-26-34-27(32-16-4-2)36-28(35-26)37-17-13-24(14-18-37)33-19-25(20-5-9-22(29)10-6-20)21-7-11-23(30)12-8-21/h3-12,24-25,33H,1-2,13-19H2,(H2,31,32,34,35,36)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	89	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053871 (Allyl-(9-allyl-6-{4-[(5H-dibenzo[a,d]cyclohepten-5...) Show SMILES C=CCNc1nc(N2CCC(CC2)NCC2c3ccccc3C=Cc3ccccc23)c2ncn(CC=C)c2n1 |c:24| Show InChI InChI=1S/C32H35N7/c1-3-17-33-32-36-30(29-31(37-32)39(18-4-2)22-35-29)38-19-15-25(16-20-38)34-21-28-26-11-7-5-9-23(26)13-14-24-10-6-8-12-27(24)28/h3-14,22,25,28,34H,1-2,15-21H2,(H,33,36,37)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053896 (Allyl-(9-allyl-6-{4-[(6,11-dihydro-dibenzo[b,e]oxe...) Show SMILES C=CCNc1nc(N2CCC(CC2)NCC2c3ccccc3COc3ccccc23)c2ncn(CC=C)c2n1 Show InChI InChI=1S/C31H35N7O/c1-3-15-32-31-35-29(28-30(36-31)38(16-4-2)21-34-28)37-17-13-23(14-18-37)33-19-26-24-10-6-5-9-22(24)20-39-27-12-8-7-11-25(26)27/h3-12,21,23,26,33H,1-2,13-20H2,(H,32,35,36)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	93	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053895 (Allyl-(9-allyl-2-{4-[(2,3,4-trimethoxy-10,11-dihyd...) Show SMILES COc1cc2CCc3ccccc3C(CNC3CCN(CC3)c3nc(NCC=C)c4ncn(CC=C)c4n3)c2c(OC)c1OC Show InChI InChI=1S/C35H43N7O3/c1-6-16-36-33-30-34(42(17-7-2)22-38-30)40-35(39-33)41-18-14-25(15-19-41)37-21-27-26-11-9-8-10-23(26)12-13-24-20-28(43-3)31(44-4)32(45-5)29(24)27/h6-11,20,22,25,27,37H,1-2,12-19,21H2,3-5H3,(H,36,39,40)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	99	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053893 (Allyl-(9-allyl-6-{4-[(2-methoxy-10,11-dihydro-5H-d...) Show SMILES COc1ccc2C(CNC3CCN(CC3)c3nc(NCC=C)nc4n(CC=C)cnc34)c3ccccc3CCc2c1 Show InChI InChI=1S/C33H39N7O/c1-4-16-34-33-37-31(30-32(38-33)40(17-5-2)22-36-30)39-18-14-25(15-19-39)35-21-29-27-9-7-6-8-23(27)10-11-24-20-26(41-3)12-13-28(24)29/h4-9,12-13,20,22,25,29,35H,1-2,10-11,14-19,21H2,3H3,(H,34,37,38)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	110	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053870 (Allyl-(9-allyl-2-{4-[(6,11-dihydro-dibenzo[b,e]oxe...) Show SMILES C=CCNc1nc(nc2n(CC=C)cnc12)N1CCC(CC1)NCC1c2ccccc2COc2ccccc12 Show InChI InChI=1S/C31H35N7O/c1-3-15-32-29-28-30(38(16-4-2)21-34-28)36-31(35-29)37-17-13-23(14-18-37)33-19-26-24-10-6-5-9-22(24)20-39-27-12-8-7-11-25(26)27/h3-12,21,23,26,33H,1-2,13-20H2,(H,32,35,36)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	120	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053898 (Allyl-(9-allyl-6-{4-[(8-chloro-11-methyl-10,10-dio...) Show SMILES CN1c2ccccc2C(CNC2CCN(CC2)c2nc(NCC=C)nc3n(CC=C)cnc23)c2ccc(Cl)cc2S1(=O)=O Show InChI InChI=1S/C31H35ClN8O2S/c1-4-14-33-31-36-29(28-30(37-31)40(15-5-2)20-35-28)39-16-12-22(13-17-39)34-19-25-23-8-6-7-9-26(23)38(3)43(41,42)27-18-21(32)10-11-24(25)27/h4-11,18,20,22,25,34H,1-2,12-17,19H2,3H3,(H,33,36,37)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	170	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053875 (Allyl-(9-allyl-2-{4-[(5H-dibenzo[a,d]cyclohepten-5...) Show SMILES C=CCNc1nc(nc2n(CC=C)cnc12)N1CCC(CC1)NCC1c2ccccc2C=Cc2ccccc12 |c:35| Show InChI InChI=1S/C32H35N7/c1-3-17-33-30-29-31(39(18-4-2)22-35-29)37-32(36-30)38-19-15-25(16-20-38)34-21-28-26-11-7-5-9-23(26)13-14-24-10-6-8-12-27(24)28/h3-14,22,25,28,34H,1-2,15-21H2,(H,33,36,37)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	170	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053883 (Allyl-(7-allyl-2-{4-[(10,11-dihydro-5H-dibenzo[a,d...) Show SMILES C=CCNc1nc(nc2n(CC=C)ccc12)N1CCC(CC1)NCC1c2ccccc2CCc2ccccc12 Show InChI InChI=1S/C33H38N6/c1-3-18-34-31-29-17-22-38(19-4-2)32(29)37-33(36-31)39-20-15-26(16-21-39)35-23-30-27-11-7-5-9-24(27)13-14-25-10-6-8-12-28(25)30/h3-12,17,22,26,30,35H,1-2,13-16,18-21,23H2,(H,34,36,37)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053884 (Allyl-(1-allyl-6-{4-[(10,11-dihydro-5H-dibenzo[a,d...) Show SMILES C=CCNc1nc(nc2n(CC=C)ncc12)N1CCC(CC1)NCC1c2ccccc2CCc2ccccc12 Show InChI InChI=1S/C32H37N7/c1-3-17-33-30-29-22-35-39(18-4-2)31(29)37-32(36-30)38-19-15-25(16-20-38)34-21-28-26-11-7-5-9-23(26)13-14-24-10-6-8-12-27(24)28/h3-12,22,25,28,34H,1-2,13-21H2,(H,33,36,37)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	270	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053881 (Allyl-(1-allyl-6-{4-[(2-methoxy-10,11-dihydro-5H-d...) Show SMILES COc1ccc2C(CNC3CCN(CC3)c3nc(NCC=C)c4cnn(CC=C)c4n3)c3ccccc3CCc2c1 Show InChI InChI=1S/C33H39N7O/c1-4-16-34-31-30-22-36-40(17-5-2)32(30)38-33(37-31)39-18-14-25(15-19-39)35-21-29-27-9-7-6-8-23(27)10-11-24-20-26(41-3)12-13-28(24)29/h4-9,12-13,20,22,25,29,35H,1-2,10-11,14-19,21H2,3H3,(H,34,37,38)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053874 (Allyl-{9-allyl-2-[4-(2,2,2-triphenyl-ethylamino)-p...) Show SMILES C=CCNc1nc(nc2n(CC=C)cnc12)N1CCC(CC1)NCC(c1ccccc1)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C36H39N7/c1-3-22-37-33-32-34(43(23-4-2)27-39-32)41-35(40-33)42-24-20-31(21-25-42)38-26-36(28-14-8-5-9-15-28,29-16-10-6-11-17-29)30-18-12-7-13-19-30/h3-19,27,31,38H,1-2,20-26H2,(H,37,40,41)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	410	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053890 ((1-Allyl-6-{4-[(2-methoxy-10,11-dihydro-5H-dibenzo...) Show SMILES CCCNc1nc(nc2n(CC=C)ncc12)N1CCC(CC1)NCC1c2ccccc2CCc2cc(OC)ccc12 Show InChI InChI=1S/C33H41N7O/c1-4-16-34-31-30-22-36-40(17-5-2)32(30)38-33(37-31)39-18-14-25(15-19-39)35-21-29-27-9-7-6-8-23(27)10-11-24-20-26(41-3)12-13-28(24)29/h5-9,12-13,20,22,25,29,35H,2,4,10-11,14-19,21H2,1,3H3,(H,34,37,38)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	420	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053901 (Allyl-(9-allyl-2-{4-[(naphthalen-1-ylmethyl)-amino...) Show SMILES C=CCNc1nc(nc2n(CC=C)cnc12)N1CCC(CC1)NCc1cccc2ccccc12 Show InChI InChI=1S/C27H31N7/c1-3-14-28-25-24-26(34(15-4-2)19-30-24)32-27(31-25)33-16-12-22(13-17-33)29-18-21-10-7-9-20-8-5-6-11-23(20)21/h3-11,19,22,29H,1-2,12-18H2,(H,28,31,32)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	440	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053899 (Allyl-(9-allyl-2-{4-[(10,10-dioxo-11-propyl-10,11-...) Show SMILES CCCN1c2ccccc2C(CNC2CCN(CC2)c2nc(NCC=C)c3ncn(CC=C)c3n2)c2ccccc2S1(=O)=O Show InChI InChI=1S/C33H40N8O2S/c1-4-17-34-31-30-32(40(18-5-2)23-36-30)38-33(37-31)39-20-15-24(16-21-39)35-22-27-25-11-7-9-13-28(25)41(19-6-3)44(42,43)29-14-10-8-12-26(27)29/h4-5,7-14,23-24,27,35H,1-2,6,15-22H2,3H3,(H,34,37,38)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	490	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053889 (Allyl-{9-allyl-2-[4-(6,11-dihydro-dibenzo[b,e]oxep...) Show SMILES C=CCNc1nc(nc2n(CC=C)cnc12)N1CCC(CC1)NC1c2ccccc2COc2ccccc12 Show InChI InChI=1S/C30H33N7O/c1-3-15-31-28-27-29(37(16-4-2)20-32-27)35-30(34-28)36-17-13-22(14-18-36)33-26-23-10-6-5-9-21(23)19-38-25-12-8-7-11-24(25)26/h3-12,20,22,26,33H,1-2,13-19H2,(H,31,34,35)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	550	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053886 ((2-{4-[(10,11-Dihydro-5H-dibenzo[a,d]cyclohepten-5...) Show SMILES CCCNc1nc(nc2n(CCC)cnc12)N1CCC(CC1)NCC1c2ccccc2CCc2ccccc12 Show InChI InChI=1S/C32H41N7/c1-3-17-33-30-29-31(39(18-4-2)22-35-29)37-32(36-30)38-19-15-25(16-20-38)34-21-28-26-11-7-5-9-23(26)13-14-24-10-6-8-12-27(24)28/h5-12,22,25,28,34H,3-4,13-21H2,1-2H3,(H,33,36,37)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	560	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053878 (Allyl-{9-allyl-6-[4-(10,11-dihydro-5H-dibenzo[a,d]...) Show SMILES C=CCNc1nc(N2CCC(CC2)NC2c3ccccc3CCc3ccccc23)c2ncn(CC=C)c2n1 Show InChI InChI=1S/C31H35N7/c1-3-17-32-31-35-29(28-30(36-31)38(18-4-2)21-33-28)37-19-15-24(16-20-37)34-27-25-11-7-5-9-22(25)13-14-23-10-6-8-12-26(23)27/h3-12,21,24,27,34H,1-2,13-20H2,(H,32,35,36)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	620	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053897 (Allyl-{9-allyl-2-[4-(2,2-diphenyl-ethylamino)-pipe...) Show SMILES C=CCNc1nc(nc2n(CC=C)cnc12)N1CCC(CC1)NCC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C30H35N7/c1-3-17-31-28-27-29(37(18-4-2)22-33-27)35-30(34-28)36-19-15-25(16-20-36)32-21-26(23-11-7-5-8-12-23)24-13-9-6-10-14-24/h3-14,22,25-26,32H,1-2,15-21H2,(H,31,34,35)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	630	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053876 (Allyl-{9-allyl-2-[4-(10,11-dihydro-5H-dibenzo[a,d]...) Show SMILES C=CCNc1nc(nc2n(CC=C)cnc12)N1CCC(CC1)NC1c2ccccc2CCc2ccccc12 Show InChI InChI=1S/C31H35N7/c1-3-17-32-29-28-30(38(18-4-2)21-33-28)36-31(35-29)37-19-15-24(16-20-37)34-27-25-11-7-5-9-22(25)13-14-23-10-6-8-12-26(23)27/h3-12,21,24,27,34H,1-2,13-20H2,(H,32,35,36)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	770	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053887 (Allyl-(3-allyl-5-{4-[(10,11-dihydro-5H-dibenzo[a,d...) Show SMILES C=CCNc1nc(nc2n(CC=C)nnc12)N1CCC(CC1)NCC1c2ccccc2CCc2ccccc12 Show InChI InChI=1S/C31H36N8/c1-3-17-32-29-28-30(39(18-4-2)37-36-28)35-31(34-29)38-19-15-24(16-20-38)33-21-27-25-11-7-5-9-22(25)13-14-23-10-6-8-12-26(23)27/h3-12,24,27,33H,1-2,13-21H2,(H,32,34,35)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	860	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053882 (CHEMBL340348 | [1-(9-Allyl-6-allylamino-9H-purin-2...) Show SMILES CN1c2ccccc2C(NC2CCN(CC2)c2nc(NCC=C)c3ncn(CC=C)c3n2)c2ccc(Cl)cc2S1(=O)=O Show InChI InChI=1S/C30H33ClN8O2S/c1-4-14-32-28-27-29(39(15-5-2)19-33-27)36-30(35-28)38-16-12-21(13-17-38)34-26-22-8-6-7-9-24(22)37(3)42(40,41)25-18-20(31)10-11-23(25)26/h4-11,18-19,21,26,34H,1-2,12-17H2,3H3,(H,32,35,36)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053882 (CHEMBL340348 | [1-(9-Allyl-6-allylamino-9H-purin-2...) Show SMILES CN1c2ccccc2C(NC2CCN(CC2)c2nc(NCC=C)c3ncn(CC=C)c3n2)c2ccc(Cl)cc2S1(=O)=O Show InChI InChI=1S/C30H33ClN8O2S/c1-4-14-32-28-27-29(39(15-5-2)19-33-27)36-30(35-28)38-16-12-21(13-17-38)34-26-22-8-6-7-9-24(22)37(3)42(40,41)25-18-20(31)10-11-23(25)26/h4-11,18-19,21,26,34H,1-2,12-17H2,3H3,(H,32,35,36)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053879 (Allyl-(9-allyl-6-{4-[(naphthalen-1-ylmethyl)-amino...) Show SMILES C=CCNc1nc(N2CCC(CC2)NCc2cccc3ccccc23)c2ncn(CC=C)c2n1 Show InChI InChI=1S/C27H31N7/c1-3-14-28-27-31-25(24-26(32-27)34(15-4-2)19-30-24)33-16-12-22(13-17-33)29-18-21-10-7-9-20-8-5-6-11-23(20)21/h3-11,19,22,29H,1-2,12-18H2,(H,28,31,32)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S (Rattus norvegicus)	BDBM50053894 (11-{[1-(9-Allyl-6-allylamino-9H-purin-2-yl)-piperi...) Show SMILES C=CCNc1nc(nc2n(CC=C)cnc12)N1CCC(CC1)NCC1c2ccccc2NC(=O)c2ccccc12 Show InChI InChI=1S/C31H34N8O/c1-3-15-32-28-27-29(39(16-4-2)20-34-27)37-31(36-28)38-17-13-21(14-18-38)33-19-25-22-9-5-6-11-24(22)30(40)35-26-12-8-7-10-23(25)26/h3-12,20-21,25,33H,1-2,13-19H2,(H,35,40)(H,32,36,37)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	3.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of [3H]-D-888 binding to L-type [Ca2+] channel of membranes from rat skeletal muscle				J Med Chem 39: 4099-108 (1996) Article DOI: 10.1021/jm960361i BindingDB Entry DOI: 10.7270/Q2Q81C52
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM6471 (4-Anilino-7,8-dialkoxybenzo[g]quinoline-3-carbonit...) Show SMILES COc1cc(Nc2c(cnc3cc4cc(OCCN5CCOCC5)c(OC)cc4cc23)C#N)c(Cl)cc1Cl Show InChI InChI=1S/C28H26Cl2N4O4/c1-35-25-14-24(21(29)13-22(25)30)33-28-19(15-31)16-32-23-10-18-12-27(26(36-2)11-17(18)9-20(23)28)38-8-5-34-3-6-37-7-4-34/h9-14,16H,3-8H2,1-2H3,(H,32,33)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.460	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of c-SRC				Bioorg Med Chem 19: 2517-28 (2011) Article DOI: 10.1016/j.bmc.2011.03.021 BindingDB Entry DOI: 10.7270/Q2DN45CD
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM8 ((1R)-cyclohexane-1,2-diol | cis-1,2-cyclohexanedio...) Show SMILES OC1CCCC[C@H]1O |r| Show InChI InChI=1S/C6H12O2/c7-5-3-1-2-4-6(5)8/h5-8H,1-4H2/t5-,6?/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.600	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of c-SRC				Bioorg Med Chem 19: 2517-28 (2011) Article DOI: 10.1016/j.bmc.2011.03.021 BindingDB Entry DOI: 10.7270/Q2DN45CD
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM4552 (4-[(2,4-Dichloro-5-methoxyphenyl)amino]-6-methoxy-...) Show SMILES COc1cc(Nc2c(cnc3cc(OCCCN4CCN(C)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl Show InChI InChI=1S/C26H29Cl2N5O3/c1-32-6-8-33(9-7-32)5-4-10-36-25-13-21-18(11-24(25)35-3)26(17(15-29)16-30-21)31-22-14-23(34-2)20(28)12-19(22)27/h11-14,16H,4-10H2,1-3H3,(H,30,31)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of c-SRC				Bioorg Med Chem 19: 2517-28 (2011) Article DOI: 10.1016/j.bmc.2011.03.021 BindingDB Entry DOI: 10.7270/Q2DN45CD
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM12255 (AZD0530 | CHEMBL217092 | Compound 33 | N-(5-chloro...) Show SMILES CN1CCN(CCOc2cc(OC3CCOCC3)c3c(Nc4c5OCOc5ccc4Cl)ncnc3c2)CC1 Show InChI InChI=1S/C27H32ClN5O5/c1-32-6-8-33(9-7-32)10-13-35-19-14-21-24(23(15-19)38-18-4-11-34-12-5-18)27(30-16-29-21)31-25-20(28)2-3-22-26(25)37-17-36-22/h2-3,14-16,18H,4-13,17H2,1H3,(H,29,30,31)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of c-SRC				Bioorg Med Chem 19: 2517-28 (2011) Article DOI: 10.1016/j.bmc.2011.03.021 BindingDB Entry DOI: 10.7270/Q2DN45CD
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50303801 (CHEMBL571546 | N-benzyl-2-(5-(4-(2-morpholinoethox...) Show SMILES O=C(Cc1ccc(cn1)-c1ccc(OCCN2CCOCC2)cc1)NCc1ccccc1 Show InChI InChI=1S/C26H29N3O3/c30-26(28-19-21-4-2-1-3-5-21)18-24-9-6-23(20-27-24)22-7-10-25(11-8-22)32-17-14-29-12-15-31-16-13-29/h1-11,20H,12-19H2,(H,28,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of c-SRC				Bioorg Med Chem 19: 2517-28 (2011) Article DOI: 10.1016/j.bmc.2011.03.021 BindingDB Entry DOI: 10.7270/Q2DN45CD
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50342390 (3-Amino-6-(2-dimethylamino-ethylamino)-4-phenylthi...) Show SMILES CN(C)CCNc1cc(-c2ccccc2)c2c(N)c(sc2n1)C(=O)N\N=C\c1cncn1C Show InChI InChI=1S/C23H26N8OS/c1-30(2)10-9-26-18-11-17(15-7-5-4-6-8-15)19-20(24)21(33-23(19)28-18)22(32)29-27-13-16-12-25-14-31(16)3/h4-8,11-14H,9-10,24H2,1-3H3,(H,26,28)(H,29,32)/b27-13+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of c-SRC assessed as residual activity using KVEKIGEGYYGVVYK as peptide substrate after 20 mins by scintillation counting				Bioorg Med Chem 19: 2517-28 (2011) Article DOI: 10.1016/j.bmc.2011.03.021 BindingDB Entry DOI: 10.7270/Q2DN45CD
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50342392 (3-Amino-4-benzyl-6-(2-dimethylamino-ethylamino)-th...) Show SMILES CN(C)CCNc1cc(Cc2ccccc2)c2c(N)c(sc2n1)C(=O)N\N=C\c1cccn1C Show InChI InChI=1S/C25H29N7OS/c1-31(2)13-11-27-20-15-18(14-17-8-5-4-6-9-17)21-22(26)23(34-25(21)29-20)24(33)30-28-16-19-10-7-12-32(19)3/h4-10,12,15-16H,11,13-14,26H2,1-3H3,(H,27,29)(H,30,33)/b28-16+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of c-SRC assessed as residual activity using KVEKIGEGYYGVVYK as peptide substrate after 20 mins by scintillation counting				Bioorg Med Chem 19: 2517-28 (2011) Article DOI: 10.1016/j.bmc.2011.03.021 BindingDB Entry DOI: 10.7270/Q2DN45CD
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50342393 (3-Amino-6-(2-dimethylamino-ethylamino)-4-propylthi...) Show SMILES CCCc1cc(NCCN(C)C)nc2sc(C(=O)N\N=C\c3cccn3C)c(N)c12 Show InChI InChI=1S/C21H29N7OS/c1-5-7-14-12-16(23-9-11-27(2)3)25-21-17(14)18(22)19(30-21)20(29)26-24-13-15-8-6-10-28(15)4/h6,8,10,12-13H,5,7,9,11,22H2,1-4H3,(H,23,25)(H,26,29)/b24-13+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of c-SRC assessed as residual activity using KVEKIGEGYYGVVYK as peptide substrate after 20 mins by scintillation counting				Bioorg Med Chem 19: 2517-28 (2011) Article DOI: 10.1016/j.bmc.2011.03.021 BindingDB Entry DOI: 10.7270/Q2DN45CD
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50342391 (3-Amino-6-(2-dimethylamino-ethylamino)-4-phenylthi...) Show SMILES CN(C)CCNc1cc(-c2ccccc2)c2c(N)c(sc2n1)C(=O)N\N=C\c1cccn1C Show InChI InChI=1S/C24H27N7OS/c1-30(2)13-11-26-19-14-18(16-8-5-4-6-9-16)20-21(25)22(33-24(20)28-19)23(32)29-27-15-17-10-7-12-31(17)3/h4-10,12,14-15H,11,13,25H2,1-3H3,(H,26,28)(H,29,32)/b27-15+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	68	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of c-SRC assessed as residual activity using KVEKIGEGYYGVVYK as peptide substrate after 20 mins by scintillation counting				Bioorg Med Chem 19: 2517-28 (2011) Article DOI: 10.1016/j.bmc.2011.03.021 BindingDB Entry DOI: 10.7270/Q2DN45CD
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50342389 (3-Amino-6-(2-dimethylamino-ethylamino)-4-phenylthi...) Show SMILES CN(C)CCNc1cc(-c2ccccc2)c2c(N)c(sc2n1)C(=O)N\N=C\c1cccc2ccccc12 Show InChI InChI=1S/C29H28N6OS/c1-35(2)16-15-31-24-17-23(20-9-4-3-5-10-20)25-26(30)27(37-29(25)33-24)28(36)34-32-18-21-13-8-12-19-11-6-7-14-22(19)21/h3-14,17-18H,15-16,30H2,1-2H3,(H,31,33)(H,34,36)/b32-18+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	107	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of c-SRC assessed as residual activity using KVEKIGEGYYGVVYK as peptide substrate after 20 mins by scintillation counting				Bioorg Med Chem 19: 2517-28 (2011) Article DOI: 10.1016/j.bmc.2011.03.021 BindingDB Entry DOI: 10.7270/Q2DN45CD
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50342387 (3-Amino-6-(2-dimethylamino-ethylamino)-4-methylthi...) Show SMILES CN(C)CCNc1cc(C)c2c(N)c(sc2n1)C(=O)N\N=C\c1cccc2ccccc12 Show InChI InChI=1S/C24H26N6OS/c1-15-13-19(26-11-12-30(2)3)28-24-20(15)21(25)22(32-24)23(31)29-27-14-17-9-6-8-16-7-4-5-10-18(16)17/h4-10,13-14H,11-12,25H2,1-3H3,(H,26,28)(H,29,31)/b27-14+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of c-SRC assessed as residual activity using KVEKIGEGYYGVVYK as peptide substrate after 20 mins by scintillation counting				Bioorg Med Chem 19: 2517-28 (2011) Article DOI: 10.1016/j.bmc.2011.03.021 BindingDB Entry DOI: 10.7270/Q2DN45CD
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50342388 (3-Amino-6-(2-dimethylamino-ethylamino)-4-methylthi...) Show SMILES CN(C)CCNc1cc(C)c2c(N)c(sc2n1)C(=O)N\N=C\c1cccn1C Show InChI InChI=1S/C19H25N7OS/c1-12-10-14(21-7-9-25(2)3)23-19-15(12)16(20)17(28-19)18(27)24-22-11-13-6-5-8-26(13)4/h5-6,8,10-11H,7,9,20H2,1-4H3,(H,21,23)(H,24,27)/b22-11+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	246	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of c-SRC assessed as residual activity using KVEKIGEGYYGVVYK as peptide substrate after 20 mins by scintillation counting				Bioorg Med Chem 19: 2517-28 (2011) Article DOI: 10.1016/j.bmc.2011.03.021 BindingDB Entry DOI: 10.7270/Q2DN45CD
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50342379 (3-Amino-4,6-dimethyl-thieno[2,3-b]pyridine-2-carbo...) Show SMILES Cc1cc(C)c2c(N)c(sc2n1)C(=O)N\N=C\c1cccc2ccccc12 Show InChI InChI=1S/C21H18N4OS/c1-12-10-13(2)24-21-17(12)18(22)19(27-21)20(26)25-23-11-15-8-5-7-14-6-3-4-9-16(14)15/h3-11H,22H2,1-2H3,(H,25,26)/b23-11+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	269	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of c-SRC assessed as residual activity using KVEKIGEGYYGVVYK as peptide substrate after 20 mins by scintillation counting				Bioorg Med Chem 19: 2517-28 (2011) Article DOI: 10.1016/j.bmc.2011.03.021 BindingDB Entry DOI: 10.7270/Q2DN45CD
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50342386 (3-Amino-4-methyl-6-trifluoromethyl-thieno[2,3-b]py...) Show SMILES Cc1cc(nc2sc(C(=O)N\N=C\c3cncn3C)c(N)c12)C(F)(F)F Show InChI InChI=1S/C15H13F3N6OS/c1-7-3-9(15(16,17)18)22-14-10(7)11(19)12(26-14)13(25)23-21-5-8-4-20-6-24(8)2/h3-6H,19H2,1-2H3,(H,23,25)/b21-5+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	330	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of c-SRC assessed as residual activity using KVEKIGEGYYGVVYK as peptide substrate after 20 mins by scintillation counting				Bioorg Med Chem 19: 2517-28 (2011) Article DOI: 10.1016/j.bmc.2011.03.021 BindingDB Entry DOI: 10.7270/Q2DN45CD
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50342381 (3-Amino-4,6-dimethyl-thieno[2,3-b]pyridine-2-carbo...) Show SMILES Cc1cc(C)c2c(N)c(sc2n1)C(=O)N\N=C\c1cncn1C Show InChI InChI=1S/C15H16N6OS/c1-8-4-9(2)19-15-11(8)12(16)13(23-15)14(22)20-18-6-10-5-17-7-21(10)3/h4-7H,16H2,1-3H3,(H,20,22)/b18-6+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	769	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of c-SRC assessed as residual activity using KVEKIGEGYYGVVYK as peptide substrate after 20 mins by scintillation counting				Bioorg Med Chem 19: 2517-28 (2011) Article DOI: 10.1016/j.bmc.2011.03.021 BindingDB Entry DOI: 10.7270/Q2DN45CD
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50342384 (3-Amino-4,6-dimethyl-thieno[2,3-b]pyridine-2-carbo...) Show SMILES Cc1cc(C)c2c(N)c(sc2n1)C(=O)N\N=C\c1cccn1C Show InChI InChI=1S/C16H17N5OS/c1-9-7-10(2)19-16-12(9)13(17)14(23-16)15(22)20-18-8-11-5-4-6-21(11)3/h4-8H,17H2,1-3H3,(H,20,22)/b18-8+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	840	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by ChEMBL					Assay Description Inhibition of c-SRC assessed as residual activity using KVEKIGEGYYGVVYK as peptide substrate after 20 mins by scintillation counting				Bioorg Med Chem 19: 2517-28 (2011) Article DOI: 10.1016/j.bmc.2011.03.021 BindingDB Entry DOI: 10.7270/Q2DN45CD
					More data for this Ligand-Target Pair

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