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Compile Data Set for Download or QSAR

Found 2364 hits with Last Name = 'nargund' and Initial = 'rp'   
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
Ghrelin receptor


(Homo sapiens (Human))
BDBM50049478
PNG
(1-{[(2R)-3-(benzyloxy)-1-{1-methanesulfonyl-1,2-di...)
Show SMILES CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CN(c3ccccc23)S(C)(=O)=O)CC1
Show InChI InChI=1S/C27H36N4O5S/c1-26(2,28)25(33)29-22(18-36-17-20-9-5-4-6-10-20)24(32)30-15-13-27(14-16-30)19-31(37(3,34)35)23-12-8-7-11-21(23)27/h4-12,22H,13-19,28H2,1-3H3,(H,29,33)/t22-/m1/s1
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0.240n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding Affinity of the compound against Growth hormone secretagogue receptor of swine using [35S]-MK-0677 as radioligand


J Med Chem 39: 1767-70 (1996)


Article DOI: 10.1021/jm960054c
BindingDB Entry DOI: 10.7270/Q2BK1BDG
More data for this
Ligand-Target Pair
Bombesin


(RAT)
BDBM50336889
PNG
((2S)-1,1,1-trifluoro-2-[4-(1H-pyrazol-1-yl)phenyl]...)
Show SMILES O[C@@](Cc1ncc(CC2(CC2)C(F)(F)F)[nH]1)(c1ccc(cc1)-n1cccn1)C(F)(F)F |r|
Show InChI InChI=1S/C20H18F6N4O/c21-19(22,23)17(6-7-17)10-14-12-27-16(29-14)11-18(31,20(24,25)26)13-2-4-15(5-3-13)30-9-1-8-28-30/h1-5,8-9,12,31H,6-7,10-11H2,(H,27,29)/t18-/m0/s1
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0.600n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]Bag-3 from rat BRS-3


ACS Med Chem Lett 2: 43-47 (2011)


Article DOI: 10.1021/ml100196d
BindingDB Entry DOI: 10.7270/Q26D5T81
More data for this
Ligand-Target Pair
Bombesin


(RAT)
BDBM50336889
PNG
((2S)-1,1,1-trifluoro-2-[4-(1H-pyrazol-1-yl)phenyl]...)
Show SMILES O[C@@](Cc1ncc(CC2(CC2)C(F)(F)F)[nH]1)(c1ccc(cc1)-n1cccn1)C(F)(F)F |r|
Show InChI InChI=1S/C20H18F6N4O/c21-19(22,23)17(6-7-17)10-14-12-27-16(29-14)11-18(31,20(24,25)26)13-2-4-15(5-3-13)30-9-1-8-28-30/h1-5,8-9,12,31H,6-7,10-11H2,(H,27,29)/t18-/m0/s1
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0.600n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]Bag-3 from rat BRS-3


ACS Med Chem Lett 2: 43-47 (2011)


Article DOI: 10.1021/ml100196d
BindingDB Entry DOI: 10.7270/Q26D5T81
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50369890
PNG
(CHEMBL1237140 | CHEMBL1788167)
Show SMILES CCCCC1(CCCC)N[C@@H](Cc2c1[nH]c1ccccc21)c1nc(c[nH]1)-c1ccccc1 |r|
Show InChI InChI=1S/C28H34N4/c1-3-5-16-28(17-6-4-2)26-22(21-14-10-11-15-23(21)30-26)18-24(32-28)27-29-19-25(31-27)20-12-8-7-9-13-20/h7-15,19,24,30,32H,3-6,16-18H2,1-2H3,(H,29,31)/t24-/m0/s1
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0.640n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021074
PNG
(CHEMBL3287628)
Show SMILES Clc1ccc(CN[C@H]2CCCC[C@H]2NC(=O)c2ccc3ccccc3c2)cc1Cl |r|
Show InChI InChI=1S/C24H24Cl2N2O/c25-20-12-9-16(13-21(20)26)15-27-22-7-3-4-8-23(22)28-24(29)19-11-10-17-5-1-2-6-18(17)14-19/h1-2,5-6,9-14,22-23,27H,3-4,7-8,15H2,(H,28,29)/t22-,23+/m0/s1
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0.815n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110470
PNG
(CHEMBL3605798)
Show SMILES Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCCC1)NCCCc1ccccc1
Show InChI InChI=1S/C24H29N3/c1-19-11-13-21(14-12-19)22-18-25-23(27-22)24(15-5-6-16-24)26-17-7-10-20-8-3-2-4-9-20/h2-4,8-9,11-14,18,26H,5-7,10,15-17H2,1H3,(H,25,27)
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1.30n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Bombesin receptor subtype-3


(Mus musculus)
BDBM50336889
PNG
((2S)-1,1,1-trifluoro-2-[4-(1H-pyrazol-1-yl)phenyl]...)
Show SMILES O[C@@](Cc1ncc(CC2(CC2)C(F)(F)F)[nH]1)(c1ccc(cc1)-n1cccn1)C(F)(F)F |r|
Show InChI InChI=1S/C20H18F6N4O/c21-19(22,23)17(6-7-17)10-14-12-27-16(29-14)11-18(31,20(24,25)26)13-2-4-15(5-3-13)30-9-1-8-28-30/h1-5,8-9,12,31H,6-7,10-11H2,(H,27,29)/t18-/m0/s1
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1.60n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]Bag-3 from mouse BRS-3


ACS Med Chem Lett 2: 43-47 (2011)


Article DOI: 10.1021/ml100196d
BindingDB Entry DOI: 10.7270/Q26D5T81
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110461
PNG
(CHEMBL3605789)
Show SMILES Fc1ccc(cc1)-c1c[nH]c(n1)C1(CCCC1)NCc1c[nH]c2ccccc12
Show InChI InChI=1S/C23H23FN4/c24-18-9-7-16(8-10-18)21-15-26-22(28-21)23(11-3-4-12-23)27-14-17-13-25-20-6-2-1-5-19(17)20/h1-2,5-10,13,15,25,27H,3-4,11-12,14H2,(H,26,28)
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2n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021075
PNG
(CHEMBL3287629)
Show SMILES Fc1ccc2cc(ccc2c1)C(=O)N[C@@H]1CCCC[C@@H]1NCc1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C24H23Cl2FN2O/c25-20-10-5-15(11-21(20)26)14-28-22-3-1-2-4-23(22)29-24(30)18-7-6-17-13-19(27)9-8-16(17)12-18/h5-13,22-23,28H,1-4,14H2,(H,29,30)/t22-,23+/m0/s1
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3n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110440
PNG
(CHEMBL3605785)
Show SMILES Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCCC1)NCc1c[nH]c2ccccc12
Show InChI InChI=1S/C24H26N4/c1-17-8-10-18(11-9-17)22-16-26-23(28-22)24(12-4-5-13-24)27-15-19-14-25-21-7-3-2-6-20(19)21/h2-3,6-11,14,16,25,27H,4-5,12-13,15H2,1H3,(H,26,28)
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3.40n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021090
PNG
(CHEMBL3287632)
Show SMILES Fc1ccc(cc1)C(=O)N[C@@H]1CCCC[C@H]1NCc1c[nH]c2ccccc12 |r|
Show InChI InChI=1S/C22H24FN3O/c23-17-11-9-15(10-12-17)22(27)26-21-8-4-3-7-20(21)25-14-16-13-24-19-6-2-1-5-18(16)19/h1-2,5-6,9-13,20-21,24-25H,3-4,7-8,14H2,(H,26,27)/t20-,21-/m1/s1
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3.70n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
BRS3


(Homo sapiens (Human))
BDBM50336889
PNG
((2S)-1,1,1-trifluoro-2-[4-(1H-pyrazol-1-yl)phenyl]...)
Show SMILES O[C@@](Cc1ncc(CC2(CC2)C(F)(F)F)[nH]1)(c1ccc(cc1)-n1cccn1)C(F)(F)F |r|
Show InChI InChI=1S/C20H18F6N4O/c21-19(22,23)17(6-7-17)10-14-12-27-16(29-14)11-18(31,20(24,25)26)13-2-4-15(5-3-13)30-9-1-8-28-30/h1-5,8-9,12,31H,6-7,10-11H2,(H,27,29)/t18-/m0/s1
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3.70n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-[D-Tyr6,beta-Ala11,Phe13,Nle14]-Bombesin (6-14) from human BRS-3


ACS Med Chem Lett 2: 43-47 (2011)


Article DOI: 10.1021/ml100196d
BindingDB Entry DOI: 10.7270/Q26D5T81
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021063
PNG
(CHEMBL3287613)
Show SMILES Fc1ccc(cc1)C(=O)N[C@@H]1CCCC[C@@H]1NCc1c[nH]c2ccccc12 |r|
Show InChI InChI=1S/C22H24FN3O/c23-17-11-9-15(10-12-17)22(27)26-21-8-4-3-7-20(21)25-14-16-13-24-19-6-2-1-5-18(16)19/h1-2,5-6,9-13,20-21,24-25H,3-4,7-8,14H2,(H,26,27)/t20-,21+/m0/s1
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3.80n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021109
PNG
(CHEMBL3287633)
Show SMILES Fc1ccc(cc1)C(=O)N[C@@H]1CCC[C@@H]1NCc1c[nH]c2ccccc12 |r|
Show InChI InChI=1S/C21H22FN3O/c22-16-10-8-14(9-11-16)21(26)25-20-7-3-6-19(20)24-13-15-12-23-18-5-2-1-4-17(15)18/h1-2,4-5,8-12,19-20,23-24H,3,6-7,13H2,(H,25,26)/t19-,20+/m0/s1
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4.20n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021073
PNG
(CHEMBL3287627)
Show SMILES Fc1ccc(cc1F)C(=O)N[C@@H]1CCCC[C@@H]1NCc1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C20H20Cl2F2N2O/c21-14-7-5-12(9-15(14)22)11-25-18-3-1-2-4-19(18)26-20(27)13-6-8-16(23)17(24)10-13/h5-10,18-19,25H,1-4,11H2,(H,26,27)/t18-,19+/m0/s1
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4.5n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110467
PNG
(CHEMBL3605795)
Show SMILES Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCCC1)NCc1cc2ccccc2[nH]1
Show InChI InChI=1S/C24H26N4/c1-17-8-10-18(11-9-17)22-16-25-23(28-22)24(12-4-5-13-24)26-15-20-14-19-6-2-3-7-21(19)27-20/h2-3,6-11,14,16,26-27H,4-5,12-13,15H2,1H3,(H,25,28)
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4.90n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110441
PNG
(CHEMBL3605786)
Show SMILES Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCCCC1)NCc1c[nH]c2ccccc12
Show InChI InChI=1S/C25H28N4/c1-18-9-11-19(12-10-18)23-17-27-24(29-23)25(13-5-2-6-14-25)28-16-20-15-26-22-8-4-3-7-21(20)22/h3-4,7-12,15,17,26,28H,2,5-6,13-14,16H2,1H3,(H,27,29)
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5.30n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110460
PNG
(CHEMBL3605788)
Show SMILES C(NC1(CCCC1)c1nc(c[nH]1)-c1ccccc1)c1c[nH]c2ccccc12
Show InChI InChI=1S/C23H24N4/c1-2-8-17(9-3-1)21-16-25-22(27-21)23(12-6-7-13-23)26-15-18-14-24-20-11-5-4-10-19(18)20/h1-5,8-11,14,16,24,26H,6-7,12-13,15H2,(H,25,27)
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5.40n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Ghrelin receptor


(Homo sapiens (Human))
BDBM50049479
PNG
((S)-6-Amino-2-{(R)-2-[(S)-2-{(S)-2-[(R)-2-[(S)-2-a...)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O
Show InChI InChI=1S/C46H56N12O6/c1-27(54-44(62)39(20-29-23-51-35-15-7-5-13-32(29)35)57-43(61)34(48)22-31-25-50-26-53-31)42(60)56-40(21-30-24-52-36-16-8-6-14-33(30)36)46(64)58-38(19-28-11-3-2-4-12-28)45(63)55-37(41(49)59)17-9-10-18-47/h2-8,11-16,23-27,34,37-40,51-52H,9-10,17-22,47-48H2,1H3,(H2,49,59)(H,50,53)(H,54,62)(H,55,63)(H,56,60)(H,57,61)(H,58,64)/t27-,34-,37-,38+,39+,40-/m0/s1
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6n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding Affinity of the compound against Growth hormone secretagogue receptor of swine using [35S]-MK-0677 as radioligand


J Med Chem 39: 1767-70 (1996)


Article DOI: 10.1021/jm960054c
BindingDB Entry DOI: 10.7270/Q2BK1BDG
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021064
PNG
(CHEMBL3287614)
Show SMILES Fc1ccc(cc1)C(=O)N[C@@H]1CCCC[C@@H]1NCc1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C20H21Cl2FN2O/c21-16-10-5-13(11-17(16)22)12-24-18-3-1-2-4-19(18)25-20(26)14-6-8-15(23)9-7-14/h5-11,18-19,24H,1-4,12H2,(H,25,26)/t18-,19+/m0/s1
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6.80n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021057
PNG
(CHEMBL3287647)
Show SMILES Fc1ccc(NC(=O)N[C@@H]2CCCC[C@@H]2NCc2ccc(Cl)c(Cl)c2)cc1 |r|
Show InChI InChI=1S/C20H22Cl2FN3O/c21-16-10-5-13(11-17(16)22)12-24-18-3-1-2-4-19(18)26-20(27)25-15-8-6-14(23)7-9-15/h5-11,18-19,24H,1-4,12H2,(H2,25,26,27)/t18-,19+/m0/s1
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9n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021060
PNG
(CHEMBL3287649)
Show SMILES Fc1ccc(NC(=O)[C@@H]2CCCC[C@@H]2NCc2c[nH]c3ccccc23)cc1 |r|
Show InChI InChI=1S/C22H24FN3O/c23-16-9-11-17(12-10-16)26-22(27)19-6-2-4-8-21(19)25-14-15-13-24-20-7-3-1-5-18(15)20/h1,3,5,7,9-13,19,21,24-25H,2,4,6,8,14H2,(H,26,27)/t19-,21+/m1/s1
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16n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021102
PNG
(CHEMBL3287611)
Show SMILES O=C(N[C@@H]1CCCC[C@@H]1NCc1cc2ccccc2[nH]1)c1ccccc1 |r|
Show InChI InChI=1S/C22H25N3O/c26-22(16-8-2-1-3-9-16)25-21-13-7-6-12-20(21)23-15-18-14-17-10-4-5-11-19(17)24-18/h1-5,8-11,14,20-21,23-24H,6-7,12-13,15H2,(H,25,26)/t20-,21+/m0/s1
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17n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021067
PNG
(CHEMBL3287617)
Show SMILES COc1ccc(CN[C@H]2CCCC[C@H]2NC(=O)c2ccc(F)cc2)cc1 |r|
Show InChI InChI=1S/C21H25FN2O2/c1-26-18-12-6-15(7-13-18)14-23-19-4-2-3-5-20(19)24-21(25)16-8-10-17(22)11-9-16/h6-13,19-20,23H,2-5,14H2,1H3,(H,24,25)/t19-,20+/m0/s1
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21n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110477
PNG
(CHEMBL3605805)
Show SMILES Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCCC1)NCc1ccc(F)cc1
Show InChI InChI=1S/C22H24FN3/c1-16-4-8-18(9-5-16)20-15-24-21(26-20)22(12-2-3-13-22)25-14-17-6-10-19(23)11-7-17/h4-11,15,25H,2-3,12-14H2,1H3,(H,24,26)
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23n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110466
PNG
(CHEMBL3605794)
Show SMILES COc1cccc2c(CNC3(CCCC3)c3nc(c[nH]3)-c3ccc(C)cc3)c[nH]c12
Show InChI InChI=1S/C25H28N4O/c1-17-8-10-18(11-9-17)21-16-27-24(29-21)25(12-3-4-13-25)28-15-19-14-26-23-20(19)6-5-7-22(23)30-2/h5-11,14,16,26,28H,3-4,12-13,15H2,1-2H3,(H,27,29)
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24n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110465
PNG
(CHEMBL3605793)
Show SMILES Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCCC1)NCc1c[nH]c2cccnc12
Show InChI InChI=1S/C23H25N5/c1-16-6-8-17(9-7-16)20-15-26-22(28-20)23(10-2-3-11-23)27-14-18-13-25-19-5-4-12-24-21(18)19/h4-9,12-13,15,25,27H,2-3,10-11,14H2,1H3,(H,26,28)
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24n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021062
PNG
(CHEMBL3287652)
Show SMILES CCCCC(NC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccc(cc1)[N+]([O-])=O)C(=O)N[C@@H](CCCCN)C(=O)OC |r|
Show InChI InChI=1S/C29H40N6O7/c1-3-4-12-23(26(36)32-24(28(38)42-2)13-8-9-18-30)33-29(39)34-25(19-20-10-6-5-7-11-20)27(37)31-21-14-16-22(17-15-21)35(40)41/h5-7,10-11,14-17,23-25H,3-4,8-9,12-13,18-19,30H2,1-2H3,(H,31,37)(H,32,36)(H2,33,34,39)/t23?,24-,25-/m0/s1
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24n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110463
PNG
(CHEMBL3605791)
Show SMILES Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCCC1)NCc1cn(C)c2ccccc12
Show InChI InChI=1S/C25H28N4/c1-18-9-11-19(12-10-18)22-16-26-24(28-22)25(13-5-6-14-25)27-15-20-17-29(2)23-8-4-3-7-21(20)23/h3-4,7-12,16-17,27H,5-6,13-15H2,1-2H3,(H,26,28)
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26n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110490
PNG
(CHEMBL3605812)
Show SMILES Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCCC1)NCC1CCCCC1
Show InChI InChI=1S/C22H31N3/c1-17-9-11-19(12-10-17)20-16-23-21(25-20)22(13-5-6-14-22)24-15-18-7-3-2-4-8-18/h9-12,16,18,24H,2-8,13-15H2,1H3,(H,23,25)
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27n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021091
PNG
(CHEMBL3287635)
Show SMILES Fc1ccc(cc1F)C(=O)N[C@@H]1CCC[C@H]1NCc1c[nH]c2ccccc12 |r|
Show InChI InChI=1S/C21H21F2N3O/c22-16-9-8-13(10-17(16)23)21(27)26-20-7-3-6-19(20)25-12-14-11-24-18-5-2-1-4-15(14)18/h1-2,4-5,8-11,19-20,24-25H,3,6-7,12H2,(H,26,27)/t19-,20-/m1/s1
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30n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110462
PNG
(CHEMBL3605790)
Show SMILES C(NC1(CCCC1)c1nc(c[nH]1)-c1ccc(cc1)-c1ccccc1)c1c[nH]c2ccccc12
Show InChI InChI=1S/C29H28N4/c1-2-8-21(9-3-1)22-12-14-23(15-13-22)27-20-31-28(33-27)29(16-6-7-17-29)32-19-24-18-30-26-11-5-4-10-25(24)26/h1-5,8-15,18,20,30,32H,6-7,16-17,19H2,(H,31,33)
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31n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021103
PNG
(CHEMBL3287612)
Show SMILES O=C(N[C@@H]1CCCC[C@@H]1NCc1c[nH]c2ccccc12)c1ccccc1 |r|
Show InChI InChI=1S/C22H25N3O/c26-22(16-8-2-1-3-9-16)25-21-13-7-6-12-20(21)24-15-17-14-23-19-11-5-4-10-18(17)19/h1-5,8-11,14,20-21,23-24H,6-7,12-13,15H2,(H,25,26)/t20-,21+/m0/s1
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32n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110474
PNG
(CHEMBL3605802)
Show SMILES COc1ccc(CNC2(CCCC2)c2nc(c[nH]2)-c2ccc(C)cc2)cc1
Show InChI InChI=1S/C23H27N3O/c1-17-5-9-19(10-6-17)21-16-24-22(26-21)23(13-3-4-14-23)25-15-18-7-11-20(27-2)12-8-18/h5-12,16,25H,3-4,13-15H2,1-2H3,(H,24,26)
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32n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110475
PNG
(CHEMBL3605803)
Show SMILES Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCCC1)NCc1ccc(Cl)cc1
Show InChI InChI=1S/C22H24ClN3/c1-16-4-8-18(9-5-16)20-15-24-21(26-20)22(12-2-3-13-22)25-14-17-6-10-19(23)11-7-17/h4-11,15,25H,2-3,12-14H2,1H3,(H,24,26)
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32n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110472
PNG
(CHEMBL3605800)
Show SMILES Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCCC1)NCCC(C)(C)C
Show InChI InChI=1S/C21H31N3/c1-16-7-9-17(10-8-16)18-15-22-19(24-18)21(11-5-6-12-21)23-14-13-20(2,3)4/h7-10,15,23H,5-6,11-14H2,1-4H3,(H,22,24)
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35n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110469
PNG
(CHEMBL3605797)
Show SMILES Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCCC1)NCCc1ccccc1
Show InChI InChI=1S/C23H27N3/c1-18-9-11-20(12-10-18)21-17-24-22(26-21)23(14-5-6-15-23)25-16-13-19-7-3-2-4-8-19/h2-4,7-12,17,25H,5-6,13-16H2,1H3,(H,24,26)
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37n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021066
PNG
(CHEMBL3287616)
Show SMILES Fc1ccc(CN[C@H]2CCCC[C@H]2NC(=O)c2ccc(F)cc2)cc1 |r|
Show InChI InChI=1S/C20H22F2N2O/c21-16-9-5-14(6-10-16)13-23-18-3-1-2-4-19(18)24-20(25)15-7-11-17(22)12-8-15/h5-12,18-19,23H,1-4,13H2,(H,24,25)/t18-,19+/m0/s1
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37n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021089
PNG
(CHEMBL3287631)
Show SMILES Clc1ccc(CN[C@H]2CCCC[C@H]2NC(=O)c2cccc3ccccc23)cc1Cl |r|
Show InChI InChI=1S/C24H24Cl2N2O/c25-20-13-12-16(14-21(20)26)15-27-22-10-3-4-11-23(22)28-24(29)19-9-5-7-17-6-1-2-8-18(17)19/h1-2,5-9,12-14,22-23,27H,3-4,10-11,15H2,(H,28,29)/t22-,23+/m0/s1
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42n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50400528
PNG
(CHEMBL2204934)
Show SMILES Fc1ccc(cc1)-c1c[nH]c(n1)[C@H]1Cc2c([nH]c3ccccc23)C(N1)(c1ccccc1)c1ccccc1 |r|
Show InChI InChI=1S/C32H25FN4/c33-24-17-15-21(16-18-24)29-20-34-31(36-29)28-19-26-25-13-7-8-14-27(25)35-30(26)32(37-28,22-9-3-1-4-10-22)23-11-5-2-6-12-23/h1-18,20,28,35,37H,19H2,(H,34,36)/t28-/m1/s1
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44n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of radiolabeled MK-499 from human ERG channel


ACS Med Chem Lett 3: 484-489 (2012)


Article DOI: 10.1021/ml300063m
BindingDB Entry DOI: 10.7270/Q2V9897C
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021108
PNG
(CHEMBL3287626)
Show SMILES COc1ccc(cc1)C(=O)N[C@@H]1CCCC[C@@H]1NCc1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C21H24Cl2N2O2/c1-27-16-9-7-15(8-10-16)21(26)25-20-5-3-2-4-19(20)24-13-14-6-11-17(22)18(23)12-14/h6-12,19-20,24H,2-5,13H2,1H3,(H,25,26)/t19-,20+/m0/s1
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48n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50091554
PNG
(CHEMBL3582308)
Show SMILES Fc1ccc(cc1)-c1c[nH]c(n1)[C@@H]1CCc2[nH]c3ccccc3c2C1 |r|
Show InChI InChI=1/C21H18FN3/c22-15-8-5-13(6-9-15)20-12-23-21(25-20)14-7-10-19-17(11-14)16-3-1-2-4-18(16)24-19/h1-6,8-9,12,14,24H,7,10-11H2,(H,23,25)/t14-/s2
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50n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of MK499 binding to human ERG


ACS Med Chem Lett 6: 513-7 (2015)


Article DOI: 10.1021/ml500514w
BindingDB Entry DOI: 10.7270/Q2M61N0H
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110439
PNG
(CHEMBL3605784)
Show SMILES Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCC1)NCc1c[nH]c2ccccc12
Show InChI InChI=1S/C23H24N4/c1-16-7-9-17(10-8-16)21-15-25-22(27-21)23(11-4-12-23)26-14-18-13-24-20-6-3-2-5-19(18)20/h2-3,5-10,13,15,24,26H,4,11-12,14H2,1H3,(H,25,27)
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51n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110459
PNG
(CHEMBL3605787)
Show SMILES Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCNCC1)NCc1c[nH]c2ccccc12
Show InChI InChI=1S/C24H27N5/c1-17-6-8-18(9-7-17)22-16-27-23(29-22)24(10-12-25-13-11-24)28-15-19-14-26-21-5-3-2-4-20(19)21/h2-9,14,16,25-26,28H,10-13,15H2,1H3,(H,27,29)
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60n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Ghrelin receptor


(Homo sapiens (Human))
BDBM50049481
PNG
((R)-N-(1-((2'-(2H-tetrazol-5-yl)biphenyl-4-yl)meth...)
Show SMILES CC(C)(N)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(cc2)-c2ccccc2-c2nnn[nH]2)C1=O
Show InChI InChI=1S/C29H31N7O2/c1-29(2,30)17-26(37)31-24-16-15-21-7-3-6-10-25(21)36(28(24)38)18-19-11-13-20(14-12-19)22-8-4-5-9-23(22)27-32-34-35-33-27/h3-14,24H,15-18,30H2,1-2H3,(H,31,37)(H,32,33,34,35)/t24-/m1/s1
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63n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding Affinity of the compound against Growth hormone secretagogue receptor of swine using [35S]-MK-0677 as radioligand


J Med Chem 39: 1767-70 (1996)


Article DOI: 10.1021/jm960054c
BindingDB Entry DOI: 10.7270/Q2BK1BDG
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021071
PNG
(CHEMBL3287621)
Show SMILES Fc1ccc(cc1)C(=O)N[C@@H]1CCCC[C@@H]1NCCCc1ccccc1 |r|
Show InChI InChI=1S/C22H27FN2O/c23-19-14-12-18(13-15-19)22(26)25-21-11-5-4-10-20(21)24-16-6-9-17-7-2-1-3-8-17/h1-3,7-8,12-15,20-21,24H,4-6,9-11,16H2,(H,25,26)/t20-,21+/m0/s1
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65n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021065
PNG
(CHEMBL3287615)
Show SMILES Cc1ccc(CN[C@H]2CCCC[C@H]2NC(=O)c2ccc(F)cc2)cc1 |r|
Show InChI InChI=1S/C21H25FN2O/c1-15-6-8-16(9-7-15)14-23-19-4-2-3-5-20(19)24-21(25)17-10-12-18(22)13-11-17/h6-13,19-20,23H,2-5,14H2,1H3,(H,24,25)/t19-,20+/m0/s1
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65n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110478
PNG
(CHEMBL3605806)
Show SMILES Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCCC1)NCc1cccc(F)c1
Show InChI InChI=1S/C22H24FN3/c1-16-7-9-18(10-8-16)20-15-24-21(26-20)22(11-2-3-12-22)25-14-17-5-4-6-19(23)13-17/h4-10,13,15,25H,2-3,11-12,14H2,1H3,(H,24,26)
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72n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50110464
PNG
(CHEMBL3605792)
Show SMILES Cc1ccc(cc1)-c1c[nH]c(n1)C1(CCCC1)NCCc1c[nH]c2ccccc12
Show InChI InChI=1S/C25H28N4/c1-18-8-10-19(11-9-18)23-17-27-24(29-23)25(13-4-5-14-25)28-15-12-20-16-26-22-7-3-2-6-21(20)22/h2-3,6-11,16-17,26,28H,4-5,12-15H2,1H3,(H,27,29)
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73n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS-14 from human SSTR3 expressed in CHO cells after 60 to 90 mins


Bioorg Med Chem Lett 25: 3520-5 (2015)


BindingDB Entry DOI: 10.7270/Q29W0H9M
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM50021072
PNG
(CHEMBL3287622)
Show SMILES CC(C)(C)CCN[C@H]1CCCC[C@H]1NC(=O)c1ccc(F)cc1 |r|
Show InChI InChI=1S/C19H29FN2O/c1-19(2,3)12-13-21-16-6-4-5-7-17(16)22-18(23)14-8-10-15(20)11-9-14/h8-11,16-17,21H,4-7,12-13H2,1-3H3,(H,22,23)/t16-,17+/m0/s1
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76n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]SS14 from human SST3 expressed in CHO membrane after 60 to 90 mins by scintillation counting


ACS Med Chem Lett 5: 690-5 (2014)


Article DOI: 10.1021/ml500079u
BindingDB Entry DOI: 10.7270/Q22N53V4
More data for this
Ligand-Target Pair
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