Found 72 hits with Last Name = 'pierre' 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 | |
Lysosomal alpha-glucosidase
(Homo sapiens (Human)) | BDBM50285807
(CHEMBL2368787)Show SMILES OC[C@@H]1N=C(NCc2ccccc2)[C@@H](O)[C@@H](O)[C@@H]1O |r,t:3| Show InChI InChI=1S/C13H18N2O4/c16-7-9-10(17)11(18)12(19)13(15-9)14-6-8-4-2-1-3-5-8/h1-5,9-12,16-19H,6-7H2,(H,14,15)/t9-,10+,11-,12-/m0/s1 | PDB
NCI pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article
| 6.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Inhibition against beta-glucosidase in sweet almond |
Bioorg Med Chem Lett 5: 2655-2660 (1995)
Article DOI: 10.1016/0960-894X(95)00474-8 BindingDB Entry DOI: 10.7270/Q21R6R0W |
More data for this Ligand-Target Pair | |
Beta-mannosidase
(Rattus norvegicus) | BDBM50285807
(CHEMBL2368787)Show SMILES OC[C@@H]1N=C(NCc2ccccc2)[C@@H](O)[C@@H](O)[C@@H]1O |r,t:3| Show InChI InChI=1S/C13H18N2O4/c16-7-9-10(17)11(18)12(19)13(15-9)14-6-8-4-2-1-3-5-8/h1-5,9-12,16-19H,6-7H2,(H,14,15)/t9-,10+,11-,12-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article
| 6.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Inhibition against Beta-mannosidase in snail |
Bioorg Med Chem Lett 5: 2655-2660 (1995)
Article DOI: 10.1016/0960-894X(95)00474-8 BindingDB Entry DOI: 10.7270/Q21R6R0W |
More data for this Ligand-Target Pair | |
Beta-mannosidase
(Rattus norvegicus) | BDBM50285809
(CHEMBL2368788)Show SMILES CO[C@H]1O[C@@H](CNC2=N[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@H]1O |r,t:7| Show InChI InChI=1S/C13H24N2O9/c1-23-13-11(22)9(20)7(18)5(24-13)2-14-12-10(21)8(19)6(17)4(3-16)15-12/h4-11,13,16-22H,2-3H2,1H3,(H,14,15)/t4-,5-,6+,7+,8-,9-,10-,11+,13-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article
| 1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Inhibition against Beta-mannosidase in snail |
Bioorg Med Chem Lett 5: 2655-2660 (1995)
Article DOI: 10.1016/0960-894X(95)00474-8 BindingDB Entry DOI: 10.7270/Q21R6R0W |
More data for this Ligand-Target Pair | |
Lysosomal alpha-glucosidase
(Homo sapiens (Human)) | BDBM50285809
(CHEMBL2368788)Show SMILES CO[C@H]1O[C@@H](CNC2=N[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@H]1O |r,t:7| Show InChI InChI=1S/C13H24N2O9/c1-23-13-11(22)9(20)7(18)5(24-13)2-14-12-10(21)8(19)6(17)4(3-16)15-12/h4-11,13,16-22H,2-3H2,1H3,(H,14,15)/t4-,5-,6+,7+,8-,9-,10-,11+,13-/m0/s1 | PDB
NCI pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article
| 1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Inhibition against beta-glucosidase in sweet almond |
Bioorg Med Chem Lett 5: 2655-2660 (1995)
Article DOI: 10.1016/0960-894X(95)00474-8 BindingDB Entry DOI: 10.7270/Q21R6R0W |
More data for this Ligand-Target Pair | |
Lysosomal alpha-glucosidase
(Homo sapiens (Human)) | BDBM50285810
(6-benzylamino-2,3,4,5-tetrahydro-2-pyridiniumylmet...)Show InChI InChI=1S/C13H18N2O/c16-10-12-7-4-8-13(15-12)14-9-11-5-2-1-3-6-11/h1-3,5-6,12,16H,4,7-10H2,(H,14,15)/p+1 | PDB
NCI pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article
| 7.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Inhibition against beta-glucosidase in sweet almond |
Bioorg Med Chem Lett 5: 2655-2660 (1995)
Article DOI: 10.1016/0960-894X(95)00474-8 BindingDB Entry DOI: 10.7270/Q21R6R0W |
More data for this Ligand-Target Pair | |
Lysosomal alpha-glucosidase
(Homo sapiens (Human)) | BDBM50285808
(6N-benzyl-2,3,4,5-tetrahydro-6-pyridiniumamine)Show InChI InChI=1S/C12H16N2/c1-2-6-11(7-3-1)10-14-12-8-4-5-9-13-12/h1-3,6-7H,4-5,8-10H2,(H,13,14)/p+1 | PDB
NCI pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
PC cid PC sid UniChem
| Article
| 3.70E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Inhibition against beta-glucosidase in sweet almond |
Bioorg Med Chem Lett 5: 2655-2660 (1995)
Article DOI: 10.1016/0960-894X(95)00474-8 BindingDB Entry DOI: 10.7270/Q21R6R0W |
More data for this Ligand-Target Pair | |
Lysosomal alpha-glucosidase
(Homo sapiens (Human)) | BDBM50285806
(5-benzylamino-3,4-dihydro-2H-2-pyrroliumylmethanol)Show InChI InChI=1S/C12H16N2O/c15-9-11-6-7-12(14-11)13-8-10-4-2-1-3-5-10/h1-5,11,15H,6-9H2,(H,13,14)/p+1 | PDB
NCI pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article
| 4.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Inhibition against beta-glucosidase in sweet almond |
Bioorg Med Chem Lett 5: 2655-2660 (1995)
Article DOI: 10.1016/0960-894X(95)00474-8 BindingDB Entry DOI: 10.7270/Q21R6R0W |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50253374
((1R,4R)-4-(4-(4-(4-Fluorophenyl)-2-(2-hydroxyethyl...)Show SMILES OCCSc1nc(c([nH]1)-c1ccc(F)cc1)-c1ccnc(N[C@H]2CC[C@H](O)CC2)c1 |r,wU:25.27,wD:22.23,(34.18,-1.71,;33.44,-.36,;31.9,-.34,;31.15,1.01,;29.61,1.04,;28.68,-.19,;27.23,.31,;27.25,1.85,;28.73,2.3,;25.91,2.62,;25.92,4.17,;24.58,4.95,;23.24,4.17,;21.9,4.94,;23.24,2.62,;24.58,1.85,;25.92,-.5,;24.56,.24,;23.25,-.56,;23.29,-2.1,;24.65,-2.84,;24.69,-4.38,;23.38,-5.18,;22.03,-4.45,;20.73,-5.25,;20.76,-6.79,;19.45,-7.6,;22.12,-7.53,;23.44,-6.72,;25.96,-2.03,)| Show InChI InChI=1S/C22H25FN4O2S/c23-16-3-1-14(2-4-16)20-21(27-22(26-20)30-12-11-28)15-9-10-24-19(13-15)25-17-5-7-18(29)8-6-17/h1-4,9-10,13,17-18,28-29H,5-8,11-12H2,(H,24,25)(H,26,27)/t17-,18- | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls University of Tübingen
Curated by ChEMBL
| Assay Description Inhibition of p38alpha (unknown origin) |
J Med Chem 51: 5630-40 (2008)
Article DOI: 10.1021/jm800373t BindingDB Entry DOI: 10.7270/Q2XS5V6V |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50253323
(2-(4-(4-Fluorophenyl)-5-(2-(tetrahydro-2H-pyran-4-...)Show SMILES OCCSc1nc(c([nH]1)-c1ccc(F)cc1)-c1ccnc(NC2CCOCC2)c1 Show InChI InChI=1S/C21H23FN4O2S/c22-16-3-1-14(2-4-16)19-20(26-21(25-19)29-12-9-27)15-5-8-23-18(13-15)24-17-6-10-28-11-7-17/h1-5,8,13,17,27H,6-7,9-12H2,(H,23,24)(H,25,26) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls University of Tübingen
Curated by ChEMBL
| Assay Description Inhibition of p38alpha (unknown origin) |
J Med Chem 51: 5630-40 (2008)
Article DOI: 10.1021/jm800373t BindingDB Entry DOI: 10.7270/Q2XS5V6V |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50253906
(3-(4-(4-Fluorophenyl)-5-(2-(isopropylamino)pyridin...)Show SMILES CC(C)Nc1cc(ccn1)-c1nc(SCC(O)CO)[nH]c1-c1ccc(F)cc1 Show InChI InChI=1S/C20H23FN4O2S/c1-12(2)23-17-9-14(7-8-22-17)19-18(13-3-5-15(21)6-4-13)24-20(25-19)28-11-16(27)10-26/h3-9,12,16,26-27H,10-11H2,1-2H3,(H,22,23)(H,24,25) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls University of Tübingen
Curated by ChEMBL
| Assay Description Inhibition of p38alpha (unknown origin) |
J Med Chem 51: 5630-40 (2008)
Article DOI: 10.1021/jm800373t BindingDB Entry DOI: 10.7270/Q2XS5V6V |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50253907
(3-(4-(4-Fluorophenyl)-5-(2-(tetrahydro-2H-pyran-4-...)Show SMILES OCC(O)CSc1nc(c([nH]1)-c1ccc(F)cc1)-c1ccnc(NC2CCOCC2)c1 Show InChI InChI=1S/C22H25FN4O3S/c23-16-3-1-14(2-4-16)20-21(27-22(26-20)31-13-18(29)12-28)15-5-8-24-19(11-15)25-17-6-9-30-10-7-17/h1-5,8,11,17-18,28-29H,6-7,9-10,12-13H2,(H,24,25)(H,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls University of Tübingen
Curated by ChEMBL
| Assay Description Inhibition of p38alpha (unknown origin) |
J Med Chem 51: 5630-40 (2008)
Article DOI: 10.1021/jm800373t BindingDB Entry DOI: 10.7270/Q2XS5V6V |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50253945
((2S)-3-(4-(4-Fluorophenyl)-5-(2-(isopropylamino)py...)Show SMILES CC(C)Nc1cc(ccn1)-c1nc(SC[C@@H](O)CO)[nH]c1-c1ccc(F)cc1 |r| Show InChI InChI=1S/C20H23FN4O2S/c1-12(2)23-17-9-14(7-8-22-17)19-18(13-3-5-15(21)6-4-13)24-20(25-19)28-11-16(27)10-26/h3-9,12,16,26-27H,10-11H2,1-2H3,(H,22,23)(H,24,25)/t16-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls University of Tübingen
Curated by ChEMBL
| Assay Description Inhibition of p38alpha (unknown origin) |
J Med Chem 51: 5630-40 (2008)
Article DOI: 10.1021/jm800373t BindingDB Entry DOI: 10.7270/Q2XS5V6V |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50253322
(2-(4-(4-Fluorophenyl)-5-(2-(isopropylamino)pyridin...)Show SMILES CC(C)Nc1cc(ccn1)-c1nc(SCCO)[nH]c1-c1ccc(F)cc1 Show InChI InChI=1S/C19H21FN4OS/c1-12(2)22-16-11-14(7-8-21-16)18-17(13-3-5-15(20)6-4-13)23-19(24-18)26-10-9-25/h3-8,11-12,25H,9-10H2,1-2H3,(H,21,22)(H,23,24) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls University of Tübingen
Curated by ChEMBL
| Assay Description Inhibition of p38alpha (unknown origin) |
J Med Chem 51: 5630-40 (2008)
Article DOI: 10.1021/jm800373t BindingDB Entry DOI: 10.7270/Q2XS5V6V |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50253503
(CHEMBL522486 | Methyl 2-(4-(4-Fluorophenyl)-5-(2-(...)Show SMILES COC(=O)CSc1nc(c([nH]1)-c1ccc(F)cc1)-c1ccnc(NC(C)C)c1 Show InChI InChI=1S/C20H21FN4O2S/c1-12(2)23-16-10-14(8-9-22-16)19-18(13-4-6-15(21)7-5-13)24-20(25-19)28-11-17(26)27-3/h4-10,12H,11H2,1-3H3,(H,22,23)(H,24,25) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank 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 |
Eberhard-Karls University of Tübingen
Curated by ChEMBL
| Assay Description Inhibition of p38alpha (unknown origin) |
J Med Chem 51: 5630-40 (2008)
Article DOI: 10.1021/jm800373t BindingDB Entry DOI: 10.7270/Q2XS5V6V |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50253905
(3-(4-(4-Fluorophenyl)-5-(2-(sec-butylamino)pyridin...)Show SMILES CCC(C)Nc1cc(ccn1)-c1nc(SCC(O)CO)[nH]c1-c1ccc(F)cc1 Show InChI InChI=1S/C21H25FN4O2S/c1-3-13(2)24-18-10-15(8-9-23-18)20-19(14-4-6-16(22)7-5-14)25-21(26-20)29-12-17(28)11-27/h4-10,13,17,27-28H,3,11-12H2,1-2H3,(H,23,24)(H,25,26) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls University of Tübingen
Curated by ChEMBL
| Assay Description Inhibition of p38alpha (unknown origin) |
J Med Chem 51: 5630-40 (2008)
Article DOI: 10.1021/jm800373t BindingDB Entry DOI: 10.7270/Q2XS5V6V |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50251985
(4-(4-(4-fluorophenyl)-2-(methylthio)-1H-imidazol-5...)Show SMILES CSc1nc(c([nH]1)-c1ccc(F)cc1)-c1ccnc(NC2CCOCC2)c1 Show InChI InChI=1S/C20H21FN4OS/c1-27-20-24-18(13-2-4-15(21)5-3-13)19(25-20)14-6-9-22-17(12-14)23-16-7-10-26-11-8-16/h2-6,9,12,16H,7-8,10-11H2,1H3,(H,22,23)(H,24,25) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls University of Tübingen
Curated by ChEMBL
| Assay Description Inhibition of p38alpha (unknown origin) |
J Med Chem 51: 5630-40 (2008)
Article DOI: 10.1021/jm800373t BindingDB Entry DOI: 10.7270/Q2XS5V6V |
More data for this Ligand-Target Pair | |