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Compile Data Set for Download or QSAR

Found 4 hits of ic50 for monomerid = 50468901   
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
Guanine nucleotide-binding protein subunit alpha-11


(Homo sapiens)
BDBM50468901
PNG
(CHEMBL4294526)
Show SMILES CO[C@H](C)[C@@H]1N(C)C(=O)[C@@H](NC(=O)[C@H](C)N(C)C(=O)[C@H](C)NC(=O)C(=C)N(C)C(=O)[C@@H](Cc2ccccc2)OC(=O)[C@@H](NC(C)=O)[C@@H](C)OC1=O)[C@H](OC(=O)[C@@H](NC(=O)c1ccccc1)[C@H](O)C(C)C)C(C)C |r|
Show InChI InChI=1S/C51H71N7O15/c1-26(2)41(60)38(54-45(63)35-23-19-16-20-24-35)50(68)73-42(27(3)4)39-48(66)58(13)40(32(9)70-14)51(69)71-31(8)37(53-33(10)59)49(67)72-36(25-34-21-17-15-18-22-34)47(65)57(12)29(6)43(61)52-28(5)46(64)56(11)30(7)44(62)55-39/h15-24,26-28,30-32,36-42,60H,6,25H2,1-5,7-14H3,(H,52,61)(H,53,59)(H,54,63)(H,55,62)/t28-,30-,31+,32+,36+,37-,38-,39-,40-,41+,42+/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.34E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of recombinant human Gq/11 coupled N-terminal 3His-tagged M1 receptor expressed in CHOK1 cells assessed as reduction in carbachol-induced ...


Eur J Med Chem 156: 847-860 (2018)


Article DOI: 10.1016/j.ejmech.2018.07.023
BindingDB Entry DOI: 10.7270/Q2BP05GZ
More data for this
Ligand-Target Pair
Guanine nucleotide-binding protein subunit alpha-11


(Homo sapiens)
BDBM50468901
PNG
(CHEMBL4294526)
Show SMILES CO[C@H](C)[C@@H]1N(C)C(=O)[C@@H](NC(=O)[C@H](C)N(C)C(=O)[C@H](C)NC(=O)C(=C)N(C)C(=O)[C@@H](Cc2ccccc2)OC(=O)[C@@H](NC(C)=O)[C@@H](C)OC1=O)[C@H](OC(=O)[C@@H](NC(=O)c1ccccc1)[C@H](O)C(C)C)C(C)C |r|
Show InChI InChI=1S/C51H71N7O15/c1-26(2)41(60)38(54-45(63)35-23-19-16-20-24-35)50(68)73-42(27(3)4)39-48(66)58(13)40(32(9)70-14)51(69)71-31(8)37(53-33(10)59)49(67)72-36(25-34-21-17-15-18-22-34)47(65)57(12)29(6)43(61)52-28(5)46(64)56(11)30(7)44(62)55-39/h15-24,26-28,30-32,36-42,60H,6,25H2,1-5,7-14H3,(H,52,61)(H,53,59)(H,54,63)(H,55,62)/t28-,30-,31+,32+,36+,37-,38-,39-,40-,41+,42+/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.34E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of recombinant human Gq/11 coupled N-terminal 3His-tagged M1 receptor expressed in CHOK1 cells assessed as reduction in carbachol-induced ...


Eur J Med Chem 156: 847-860 (2018)


Article DOI: 10.1016/j.ejmech.2018.07.023
BindingDB Entry DOI: 10.7270/Q2BP05GZ
More data for this
Ligand-Target Pair
Guanine nucleotide-binding protein G(s) subunit alpha isoforms XLas


(Homo sapiens)
BDBM50468901
PNG
(CHEMBL4294526)
Show SMILES CO[C@H](C)[C@@H]1N(C)C(=O)[C@@H](NC(=O)[C@H](C)N(C)C(=O)[C@H](C)NC(=O)C(=C)N(C)C(=O)[C@@H](Cc2ccccc2)OC(=O)[C@@H](NC(C)=O)[C@@H](C)OC1=O)[C@H](OC(=O)[C@@H](NC(=O)c1ccccc1)[C@H](O)C(C)C)C(C)C |r|
Show InChI InChI=1S/C51H71N7O15/c1-26(2)41(60)38(54-45(63)35-23-19-16-20-24-35)50(68)73-42(27(3)4)39-48(66)58(13)40(32(9)70-14)51(69)71-31(8)37(53-33(10)59)49(67)72-36(25-34-21-17-15-18-22-34)47(65)57(12)29(6)43(61)52-28(5)46(64)56(11)30(7)44(62)55-39/h15-24,26-28,30-32,36-42,60H,6,25H2,1-5,7-14H3,(H,52,61)(H,53,59)(H,54,63)(H,55,62)/t28-,30-,31+,32+,36+,37-,38-,39-,40-,41+,42+/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of Gs coupled adrenergic beta2 receptor in HEK293 cells assessed as reduction in isoproterenol-induced cAMP production pretreated for 1 hr...


Eur J Med Chem 156: 847-860 (2018)


Article DOI: 10.1016/j.ejmech.2018.07.023
BindingDB Entry DOI: 10.7270/Q2BP05GZ
More data for this
Ligand-Target Pair
Guanine nucleotide-binding protein G(o) subunit alpha


(Rattus norvegicus)
BDBM50468901
PNG
(CHEMBL4294526)
Show SMILES CO[C@H](C)[C@@H]1N(C)C(=O)[C@@H](NC(=O)[C@H](C)N(C)C(=O)[C@H](C)NC(=O)C(=C)N(C)C(=O)[C@@H](Cc2ccccc2)OC(=O)[C@@H](NC(C)=O)[C@@H](C)OC1=O)[C@H](OC(=O)[C@@H](NC(=O)c1ccccc1)[C@H](O)C(C)C)C(C)C |r|
Show InChI InChI=1S/C51H71N7O15/c1-26(2)41(60)38(54-45(63)35-23-19-16-20-24-35)50(68)73-42(27(3)4)39-48(66)58(13)40(32(9)70-14)51(69)71-31(8)37(53-33(10)59)49(67)72-36(25-34-21-17-15-18-22-34)47(65)57(12)29(6)43(61)52-28(5)46(64)56(11)30(7)44(62)55-39/h15-24,26-28,30-32,36-42,60H,6,25H2,1-5,7-14H3,(H,52,61)(H,53,59)(H,54,63)(H,55,62)/t28-,30-,31+,32+,36+,37-,38-,39-,40-,41+,42+/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of recombinant rat Gi coupled mGlu2 receptor expressed in CHO cells assessed as suppression of L-glutamate-induced decrease in cAMP level ...


Eur J Med Chem 156: 847-860 (2018)


Article DOI: 10.1016/j.ejmech.2018.07.023
BindingDB Entry DOI: 10.7270/Q2BP05GZ
More data for this
Ligand-Target Pair