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Compile Data Set for Download or QSAR

Found 4 hits of ec50 data for polymerid = 49000307   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Voltage-dependent L-type calcium channel subunit alpha-1C


(RAT)
BDBM50283421
PNG
(((E)-Azacyclotridec-1-en-2-yl)-(2,2-diphenyl-penty...)
Show SMILES CCCC(CNC1=NCCCCCCCCCCC1)(c1ccccc1)c1ccccc1 |w:7.7|
Show InChI InChI=1S/C29H42N2/c1-2-23-29(26-18-12-10-13-19-26,27-20-14-11-15-21-27)25-31-28-22-16-8-6-4-3-5-7-9-17-24-30-28/h10-15,18-21H,2-9,16-17,22-25H2,1H3,(H,30,31)
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Article
n/an/an/an/a 34n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding of [3H]-nitrendipine to calcium channel in rat heart membranes


Bioorg Med Chem Lett 4: 351-354 (1994)


Article DOI: 10.1016/S0960-894X(01)80143-8
BindingDB Entry DOI: 10.7270/Q2R78F5H
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C


(RAT)
BDBM50283420
PNG
(((E)-Azacyclotridec-1-en-2-yl)-((1S,2S)-2-phenyl-c...)
Show SMILES C1C[C@H](N=C2CCCCCCCCCCCN2)[C@@H](C1)c1ccccc1 |w:4.16|
Show InChI InChI=1S/C23H36N2/c1-2-4-6-11-18-23(24-19-12-7-5-3-1)25-22-17-13-16-21(22)20-14-9-8-10-15-20/h8-10,14-15,21-22H,1-7,11-13,16-19H2,(H,24,25)/t21-,22-/m0/s1
PDB

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CHEMBL
PC cid
PC sid
UniChem

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Article
n/an/an/an/a 61n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding of [3H]-nitrendipine to calcium channel in rat heart membranes


Bioorg Med Chem Lett 4: 351-354 (1994)


Article DOI: 10.1016/S0960-894X(01)80143-8
BindingDB Entry DOI: 10.7270/Q2R78F5H
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C


(RAT)
BDBM50283420
PNG
(((E)-Azacyclotridec-1-en-2-yl)-((1S,2S)-2-phenyl-c...)
Show SMILES C1C[C@H](N=C2CCCCCCCCCCCN2)[C@@H](C1)c1ccccc1 |w:4.16|
Show InChI InChI=1S/C23H36N2/c1-2-4-6-11-18-23(24-19-12-7-5-3-1)25-22-17-13-16-21(22)20-14-9-8-10-15-20/h8-10,14-15,21-22H,1-7,11-13,16-19H2,(H,24,25)/t21-,22-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/an/an/a 61n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding of [3H]-nitrendipine to calcium channel in rat heart membranes was determined


Bioorg Med Chem Lett 4: 351-354 (1994)


Article DOI: 10.1016/S0960-894X(01)80143-8
BindingDB Entry DOI: 10.7270/Q2R78F5H
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C


(RAT)
BDBM50516235
PNG
(CHEMBL4563408)
Show SMILES FC(F)Oc1ccc(NC(=O)NC2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)cn1
Show InChI InChI=1S/C29H24Cl2F2N8O2/c30-17-5-8-20(9-6-17)41-25(21-3-1-2-4-22(21)31)39-24-26(35-16-36-27(24)41)40-13-11-18(12-14-40)37-29(42)38-19-7-10-23(34-15-19)43-28(32)33/h1-10,15-16,18,28H,11-14H2,(H2,37,38,42)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]nitrendipine from rat brain Cav1.2 dihydropyridine site after 90 mins by scintillation counting analysis


J Med Chem 62: 6330-6345 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00727
BindingDB Entry DOI: 10.7270/Q24F1V3D
More data for this
Ligand-Target Pair