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Compile Data Set for Download or QSAR

Found 42 hits Enz. Inhib. hit(s) with all data for entry = 50034857   
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
GRPR


(Homo sapiens (Human))
BDBM85484
PNG
(Bombesin)
Show SMILES CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCC(=O)N1)C(C)C)C(N)=O |wU:82.92,74.81,8.12,4.4,30.31,53.61,16.23,wD:93.101,39.52,62.69,102.104,34.35,(24.84,-22.59,;25.32,-21.13,;24.29,-19.98,;24.77,-18.52,;23.74,-17.37,;24.22,-15.91,;25.72,-15.59,;26.75,-16.74,;26.2,-14.13,;27.71,-13.81,;28.74,-14.96,;30.24,-14.64,;28.26,-16.42,;25.17,-12.98,;25.65,-11.52,;27.16,-11.2,;24.62,-10.37,;25.1,-8.91,;26.61,-8.59,;27.75,-9.62,;29.09,-8.86,;28.77,-7.35,;27.24,-7.19,;23.12,-10.69,;22.09,-9.54,;22.57,-8.08,;20.58,-9.86,;19.55,-8.72,;18.04,-9.03,;17.57,-10.5,;17.02,-7.89,;15.51,-8.2,;14.48,-7.06,;14.96,-5.59,;12.97,-7.38,;12.5,-8.84,;11.95,-6.23,;10.44,-6.55,;9.96,-8.01,;9.41,-5.4,;7.9,-5.72,;7.42,-7.18,;8.32,-8.42,;7.42,-9.66,;5.97,-9.19,;4.63,-9.96,;3.3,-9.19,;3.3,-7.65,;4.63,-6.88,;5.97,-7.65,;9.89,-3.94,;8.86,-2.79,;7.35,-3.11,;9.34,-1.33,;10.85,-1.01,;11.32,.45,;12.83,.77,;13.31,2.24,;13.86,-.37,;8.31,-.18,;8.79,1.28,;10.3,1.6,;7.76,2.43,;6.25,2.11,;5.22,3.26,;3.72,2.94,;5.7,4.72,;8.24,3.89,;9.75,4.21,;10.77,3.06,;10.22,5.67,;11.73,5.99,;12.21,7.46,;11.18,8.6,;13.72,7.77,;14.74,6.63,;16.25,6.94,;17.28,5.8,;16.73,8.41,;14.19,9.24,;13.17,10.38,;11.66,10.07,;13.64,11.85,;15.15,12.17,;15.63,13.63,;17.14,13.95,;17.61,15.41,;19.12,15.73,;19.6,17.19,;20.15,14.58,;12.62,12.99,;13.09,14.46,;14.6,14.78,;12.07,15.6,;10.56,15.29,;9.53,16.43,;8.02,16.11,;7,17.26,;7.55,14.65,;12.54,17.07,;11.52,18.21,;10.01,17.9,;11.99,19.68,;11.09,20.93,;12,22.17,;13.46,21.69,;14.71,22.59,;13.46,20.15,;17.49,-6.42,;19,-6.11,;16.47,-5.28,;22.23,-17.69,;21.75,-19.16,;21.2,-16.55,)|
Show InChI InChI=1S/C71H110N24O18S/c1-34(2)24-47(92-62(105)43(14-11-22-79-71(76)77)89-64(107)45(15-18-52(72)96)90-63(106)44-17-20-55(99)85-44)61(104)81-31-56(100)87-51(28-54(74)98)69(112)91-46(16-19-53(73)97)65(108)94-49(26-38-29-80-41-13-10-9-12-40(38)41)66(109)84-37(7)60(103)95-58(36(5)6)70(113)82-32-57(101)86-50(27-39-30-78-33-83-39)68(111)93-48(25-35(3)4)67(110)88-42(59(75)102)21-23-114-8/h9-10,12-13,29-30,33-37,42-51,58,80H,11,14-28,31-32H2,1-8H3,(H2,72,96)(H2,73,97)(H2,74,98)(H2,75,102)(H,78,83)(H,81,104)(H,82,113)(H,84,109)(H,85,99)(H,86,101)(H,87,100)(H,88,110)(H,89,107)(H,90,106)(H,91,112)(H,92,105)(H,93,111)(H,94,108)(H,95,103)(H4,76,77,79)/t37-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,58-/m0/s1
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0.150n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
GRPR


(Homo sapiens (Human))
BDBM50288252
PNG
(Bombesin analogue | CHEMBL269432)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(O)=O
Show InChI InChI=1S/C51H72N10O12/c1-28(2)20-36(54-47(68)40(24-34-25-52-27-53-34)56-45(66)38(22-32-12-9-8-10-13-32)57-49(70)42-14-11-19-61(42)31(7)63)44(65)55-37(21-29(3)4)48(69)60-43(30(5)6)50(71)58-39(23-33-15-17-35(64)18-16-33)46(67)59-41(26-62)51(72)73/h8-10,12-13,15-18,25,27-30,36-43,62,64H,11,14,19-24,26H2,1-7H3,(H,52,53)(H,54,68)(H,55,65)(H,56,66)(H,57,70)(H,58,71)(H,59,67)(H,60,69)(H,72,73)/t36-,37-,38-,39-,40-,41-,42-,43-/m0/s1
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0.700n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM85484
PNG
(Bombesin)
Show SMILES CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCC(=O)N1)C(C)C)C(N)=O |wU:82.92,74.81,8.12,4.4,30.31,53.61,16.23,wD:93.101,39.52,62.69,102.104,34.35,(24.84,-22.59,;25.32,-21.13,;24.29,-19.98,;24.77,-18.52,;23.74,-17.37,;24.22,-15.91,;25.72,-15.59,;26.75,-16.74,;26.2,-14.13,;27.71,-13.81,;28.74,-14.96,;30.24,-14.64,;28.26,-16.42,;25.17,-12.98,;25.65,-11.52,;27.16,-11.2,;24.62,-10.37,;25.1,-8.91,;26.61,-8.59,;27.75,-9.62,;29.09,-8.86,;28.77,-7.35,;27.24,-7.19,;23.12,-10.69,;22.09,-9.54,;22.57,-8.08,;20.58,-9.86,;19.55,-8.72,;18.04,-9.03,;17.57,-10.5,;17.02,-7.89,;15.51,-8.2,;14.48,-7.06,;14.96,-5.59,;12.97,-7.38,;12.5,-8.84,;11.95,-6.23,;10.44,-6.55,;9.96,-8.01,;9.41,-5.4,;7.9,-5.72,;7.42,-7.18,;8.32,-8.42,;7.42,-9.66,;5.97,-9.19,;4.63,-9.96,;3.3,-9.19,;3.3,-7.65,;4.63,-6.88,;5.97,-7.65,;9.89,-3.94,;8.86,-2.79,;7.35,-3.11,;9.34,-1.33,;10.85,-1.01,;11.32,.45,;12.83,.77,;13.31,2.24,;13.86,-.37,;8.31,-.18,;8.79,1.28,;10.3,1.6,;7.76,2.43,;6.25,2.11,;5.22,3.26,;3.72,2.94,;5.7,4.72,;8.24,3.89,;9.75,4.21,;10.77,3.06,;10.22,5.67,;11.73,5.99,;12.21,7.46,;11.18,8.6,;13.72,7.77,;14.74,6.63,;16.25,6.94,;17.28,5.8,;16.73,8.41,;14.19,9.24,;13.17,10.38,;11.66,10.07,;13.64,11.85,;15.15,12.17,;15.63,13.63,;17.14,13.95,;17.61,15.41,;19.12,15.73,;19.6,17.19,;20.15,14.58,;12.62,12.99,;13.09,14.46,;14.6,14.78,;12.07,15.6,;10.56,15.29,;9.53,16.43,;8.02,16.11,;7,17.26,;7.55,14.65,;12.54,17.07,;11.52,18.21,;10.01,17.9,;11.99,19.68,;11.09,20.93,;12,22.17,;13.46,21.69,;14.71,22.59,;13.46,20.15,;17.49,-6.42,;19,-6.11,;16.47,-5.28,;22.23,-17.69,;21.75,-19.16,;21.2,-16.55,)|
Show InChI InChI=1S/C71H110N24O18S/c1-34(2)24-47(92-62(105)43(14-11-22-79-71(76)77)89-64(107)45(15-18-52(72)96)90-63(106)44-17-20-55(99)85-44)61(104)81-31-56(100)87-51(28-54(74)98)69(112)91-46(16-19-53(73)97)65(108)94-49(26-38-29-80-41-13-10-9-12-40(38)41)66(109)84-37(7)60(103)95-58(36(5)6)70(113)82-32-57(101)86-50(27-39-30-78-33-83-39)68(111)93-48(25-35(3)4)67(110)88-42(59(75)102)21-23-114-8/h9-10,12-13,29-30,33-37,42-51,58,80H,11,14-28,31-32H2,1-8H3,(H2,72,96)(H2,73,97)(H2,74,98)(H2,75,102)(H,78,83)(H,81,104)(H,82,113)(H,84,109)(H,85,99)(H,86,101)(H,87,100)(H,88,110)(H,89,107)(H,90,106)(H,91,112)(H,92,105)(H,93,111)(H,94,108)(H,95,103)(H4,76,77,79)/t37-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,58-/m0/s1
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2n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM50288252
PNG
(Bombesin analogue | CHEMBL269432)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(O)=O
Show InChI InChI=1S/C51H72N10O12/c1-28(2)20-36(54-47(68)40(24-34-25-52-27-53-34)56-45(66)38(22-32-12-9-8-10-13-32)57-49(70)42-14-11-19-61(42)31(7)63)44(65)55-37(21-29(3)4)48(69)60-43(30(5)6)50(71)58-39(23-33-15-17-35(64)18-16-33)46(67)59-41(26-62)51(72)73/h8-10,12-13,15-18,25,27-30,36-43,62,64H,11,14,19-24,26H2,1-7H3,(H,52,53)(H,54,68)(H,55,65)(H,56,66)(H,57,70)(H,58,71)(H,59,67)(H,60,69)(H,72,73)/t36-,37-,38-,39-,40-,41-,42-,43-/m0/s1
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2.10n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM50071754
PNG
((S)-2-[3-(2,6-Diisopropyl-phenyl)-ureido]-3-(1H-in...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)N[C@@](C)(Cc1c[nH]c2ccccc12)C(=O)NCC1(CCCCC1)c1ccccn1
Show InChI InChI=1S/C37H47N5O2/c1-25(2)28-15-13-16-29(26(3)4)33(28)41-35(44)42-36(5,22-27-23-39-31-17-8-7-14-30(27)31)34(43)40-24-37(19-10-6-11-20-37)32-18-9-12-21-38-32/h7-9,12-18,21,23,25-26,39H,6,10-11,19-20,22,24H2,1-5H3,(H,40,43)(H2,41,42,44)/t36-/m0/s1
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6.30n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
Neuromedin B receptor


(Homo sapiens (Human))
BDBM50071754
PNG
((S)-2-[3-(2,6-Diisopropyl-phenyl)-ureido]-3-(1H-in...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)N[C@@](C)(Cc1c[nH]c2ccccc12)C(=O)NCC1(CCCCC1)c1ccccn1
Show InChI InChI=1S/C37H47N5O2/c1-25(2)28-15-13-16-29(26(3)4)33(28)41-35(44)42-36(5,22-27-23-39-31-17-8-7-14-30(27)31)34(43)40-24-37(19-10-6-11-20-37)32-18-9-12-21-38-32/h7-9,12-18,21,23,25-26,39H,6,10-11,19-20,22,24H2,1-5H3,(H,40,43)(H2,41,42,44)/t36-/m0/s1
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6.30n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL




Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM50288243
PNG
(2-[3-(2,6-Diisopropyl-phenyl)-ureido]-3-(1H-indol-...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(C)(Cc1c[nH]c2ccccc12)C(=O)NCC1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C38H48N4O2/c1-26(2)30-18-14-19-31(27(3)4)34(30)41-36(44)42-37(5,23-28-24-39-33-20-11-10-17-32(28)33)35(43)40-25-38(21-12-7-13-22-38)29-15-8-6-9-16-29/h6,8-11,14-20,24,26-27,39H,7,12-13,21-23,25H2,1-5H3,(H,40,43)(H2,41,42,44)
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7.80n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM50366467
PNG
(CHEMBL1907865)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)NC1CCCc2ccccc12 |r|
Show InChI InChI=1S/C35H42N4O2/c1-22(2)26-16-11-17-27(23(3)4)32(26)38-34(41)39-35(5,20-25-21-36-30-18-9-8-15-29(25)30)33(40)37-31-19-10-13-24-12-6-7-14-28(24)31/h6-9,11-12,14-18,21-23,31,36H,10,13,19-20H2,1-5H3,(H,37,40)(H2,38,39,41)/t31?,35-/m1/s1
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14n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM50288247
PNG
((R) 2-[3-(2,6-Diisopropyl-phenyl)-ureido]-3-(1H-in...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(C)(Cc1c[nH]c2ccccc12)C(=O)NC1CCCc2ccccc12
Show InChI InChI=1S/C35H42N4O2/c1-22(2)26-16-11-17-27(23(3)4)32(26)38-34(41)39-35(5,20-25-21-36-30-18-9-8-15-29(25)30)33(40)37-31-19-10-13-24-12-6-7-14-28(24)31/h6-9,11-12,14-18,21-23,31,36H,10,13,19-20H2,1-5H3,(H,37,40)(H2,38,39,41)
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72n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM50366466
PNG
(CHEMBL1907682)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)N[C@@](C)(Cc1c[nH]c2ccccc12)C(=O)NC1CCCCC1c1ccccc1 |r|
Show InChI InChI=1S/C37H46N4O2/c1-24(2)28-18-13-19-29(25(3)4)34(28)40-36(43)41-37(5,22-27-23-38-32-20-11-9-17-31(27)32)35(42)39-33-21-12-10-16-30(33)26-14-7-6-8-15-26/h6-9,11,13-15,17-20,23-25,30,33,38H,10,12,16,21-22H2,1-5H3,(H,39,42)(H2,40,41,43)/t30?,33?,37-/m0/s1
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76n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM50288238
PNG
(2-[3-(2,6-Diisopropyl-phenyl)-ureido]-N-((S)-2,2-d...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H]1COC(C)(C)OC1c1ccccc1
Show InChI InChI=1S/C37H46N4O4/c1-23(2)27-17-13-18-28(24(3)4)32(27)40-35(43)41-37(7,20-26-21-38-30-19-12-11-16-29(26)30)34(42)39-31-22-44-36(5,6)45-33(31)25-14-9-8-10-15-25/h8-19,21,23-24,31,33,38H,20,22H2,1-7H3,(H,39,42)(H2,40,41,43)/t31-,33?,37?/m0/s1
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95n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM50288239
PNG
(CHEMBL315660 | N-Cyclohexylmethyl-2-[3-(2,6-diisop...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NCC1CCCCC1
Show InChI InChI=1S/C31H42N4O2/c1-20(2)24-14-10-15-25(21(3)4)29(24)35-31(37)34-28(30(36)33-18-22-11-6-5-7-12-22)17-23-19-32-27-16-9-8-13-26(23)27/h8-10,13-16,19-22,28,32H,5-7,11-12,17-18H2,1-4H3,(H,33,36)(H2,34,35,37)
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120n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM50288244
PNG
(CHEMBL89153 | N-Cyclohexylmethyl-2-[3-(2,6-diisopr...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(C)(Cc1c[nH]c2ccccc12)C(=O)NCC1CCCCC1
Show InChI InChI=1S/C32H44N4O2/c1-21(2)25-15-11-16-26(22(3)4)29(25)35-31(38)36-32(5,30(37)34-19-23-12-7-6-8-13-23)18-24-20-33-28-17-10-9-14-27(24)28/h9-11,14-17,20-23,33H,6-8,12-13,18-19H2,1-5H3,(H,34,37)(H2,35,36,38)
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125n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM50288237
PNG
(CHEMBL88174 | N-Cyclohexylmethyl-2-[3-(2,6-diisopr...)
Show SMILES CC(C)c1cccc(C(C)C)c1N(C)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NCC1CCCCC1
Show InChI InChI=1S/C32H44N4O2/c1-21(2)25-15-11-16-26(22(3)4)30(25)36(5)32(38)35-29(31(37)34-19-23-12-7-6-8-13-23)18-24-20-33-28-17-10-9-14-27(24)28/h9-11,14-17,20-23,29,33H,6-8,12-13,18-19H2,1-5H3,(H,34,37)(H,35,38)
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260n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM50288251
PNG
(CHEMBL87090 | N-Cyclohexyl-2-[3-(2,6-diisopropyl-p...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(C)(Cc1c[nH]c2ccccc12)C(=O)NC1CCCCC1
Show InChI InChI=1S/C31H42N4O2/c1-20(2)24-15-11-16-25(21(3)4)28(24)34-30(37)35-31(5,29(36)33-23-12-7-6-8-13-23)18-22-19-32-27-17-10-9-14-26(22)27/h9-11,14-17,19-21,23,32H,6-8,12-13,18H2,1-5H3,(H,33,36)(H2,34,35,37)
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310n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM50288246
PNG
(2-[3-(2,6-Diisopropyl-phenyl)-ureido]-3-(1H-indol-...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(C)(Cc1c[nH]c2ccccc12)C(=O)NC1CCc2ccccc2C1
Show InChI InChI=1S/C35H42N4O2/c1-22(2)28-14-10-15-29(23(3)4)32(28)38-34(41)39-35(5,20-26-21-36-31-16-9-8-13-30(26)31)33(40)37-27-18-17-24-11-6-7-12-25(24)19-27/h6-16,21-23,27,36H,17-20H2,1-5H3,(H,37,40)(H2,38,39,41)
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310n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM50288250
PNG
(2-[3-(2,6-Diisopropyl-phenyl)-ureido]-N-((R)-2,2-d...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(C)(Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1COC(C)(C)OC1c1ccccc1
Show InChI InChI=1S/C37H46N4O4/c1-23(2)27-17-13-18-28(24(3)4)32(27)40-35(43)41-37(7,20-26-21-38-30-19-12-11-16-29(26)30)34(42)39-31-22-44-36(5,6)45-33(31)25-14-9-8-10-15-25/h8-19,21,23-24,31,33,38H,20,22H2,1-7H3,(H,39,42)(H2,40,41,43)/t31-,33?,37?/m1/s1
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420n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM50288249
PNG
(CHEMBL312851 | N-(1-Cyclohexyl-ethyl)-2-[3-(2,6-di...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NC(C)C1CCCCC1
Show InChI InChI=1S/C32H44N4O2/c1-20(2)25-15-11-16-26(21(3)4)30(25)36-32(38)35-29(18-24-19-33-28-17-10-9-14-27(24)28)31(37)34-22(5)23-12-7-6-8-13-23/h9-11,14-17,19-23,29,33H,6-8,12-13,18H2,1-5H3,(H,34,37)(H2,35,36,38)
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440n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM50288242
PNG
(2-[3-(2,6-Diisopropyl-phenyl)-ureido]-3-(1H-indol-...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(C)(Cc1c[nH]c2ccccc12)C(=O)NCCc1ccccc1
Show InChI InChI=1S/C33H40N4O2/c1-22(2)26-15-11-16-27(23(3)4)30(26)36-32(39)37-33(5,20-25-21-35-29-17-10-9-14-28(25)29)31(38)34-19-18-24-12-7-6-8-13-24/h6-17,21-23,35H,18-20H2,1-5H3,(H,34,38)(H2,36,37,39)
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450n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM50288241
PNG
(CHEMBL328230 | N-Cyclohexylmethyl-2-[3-(2,6-diisop...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)N(C)CC1CCCCC1
Show InChI InChI=1S/C32H44N4O2/c1-21(2)25-15-11-16-26(22(3)4)30(25)35-32(38)34-29(18-24-19-33-28-17-10-9-14-27(24)28)31(37)36(5)20-23-12-7-6-8-13-23/h9-11,14-17,19,21-23,29,33H,6-8,12-13,18,20H2,1-5H3,(H2,34,35,38)
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490n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM50288236
PNG
(2-[3-(2,6-Diisopropyl-phenyl)-ureido]-N-(2,2-dimet...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(C)(Cc1c[nH]c2ccccc12)C(=O)NC1COC(C)(C)OC1
Show InChI InChI=1S/C31H42N4O4/c1-19(2)23-12-10-13-24(20(3)4)27(23)34-29(37)35-31(7,15-21-16-32-26-14-9-8-11-25(21)26)28(36)33-22-17-38-30(5,6)39-18-22/h8-14,16,19-20,22,32H,15,17-18H2,1-7H3,(H,33,36)(H2,34,35,37)
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630n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM50288253
PNG
(CHEMBL328591 | N-Cyclohexylmethyl-2-[3-(2,6-diisop...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)N(C)C(Cc1c[nH]c2ccccc12)C(=O)NCC1CCCCC1
Show InChI InChI=1S/C32H44N4O2/c1-21(2)25-15-11-16-26(22(3)4)30(25)35-32(38)36(5)29(31(37)34-19-23-12-7-6-8-13-23)18-24-20-33-28-17-10-9-14-27(24)28/h9-11,14-17,20-23,29,33H,6-8,12-13,18-19H2,1-5H3,(H,34,37)(H,35,38)
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760n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
GRPR


(Homo sapiens (Human))
BDBM50288253
PNG
(CHEMBL328591 | N-Cyclohexylmethyl-2-[3-(2,6-diisop...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)N(C)C(Cc1c[nH]c2ccccc12)C(=O)NCC1CCCCC1
Show InChI InChI=1S/C32H44N4O2/c1-21(2)25-15-11-16-26(22(3)4)30(25)35-32(38)36(5)29(31(37)34-19-23-12-7-6-8-13-23)18-24-20-33-28-17-10-9-14-27(24)28/h9-11,14-17,20-23,29,33H,6-8,12-13,18-19H2,1-5H3,(H,34,37)(H,35,38)
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1.50E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMBR


(Homo sapiens (Human))
BDBM50288245
PNG
(2-[3-(2,6-Diisopropyl-phenyl)-ureido]-3-(1H-indol-...)
Show SMILES CNC(=O)C(C)(Cc1c[nH]c2ccccc12)NC(=O)Nc1c(cccc1C(C)C)C(C)C
Show InChI InChI=1S/C26H34N4O2/c1-16(2)19-11-9-12-20(17(3)4)23(19)29-25(32)30-26(5,24(31)27-6)14-18-15-28-22-13-8-7-10-21(18)22/h7-13,15-17,28H,14H2,1-6H3,(H,27,31)(H2,29,30,32)
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3.70E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human NMB receptor stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
GRPR


(Homo sapiens (Human))
BDBM50288247
PNG
((R) 2-[3-(2,6-Diisopropyl-phenyl)-ureido]-3-(1H-in...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(C)(Cc1c[nH]c2ccccc12)C(=O)NC1CCCc2ccccc12
Show InChI InChI=1S/C35H42N4O2/c1-22(2)26-16-11-17-27(23(3)4)32(26)38-34(41)39-35(5,20-25-21-36-30-18-9-8-15-29(25)30)33(40)37-31-19-10-13-24-12-6-7-14-28(24)31/h6-9,11-12,14-18,21-23,31,36H,10,13,19-20H2,1-5H3,(H,37,40)(H2,38,39,41)
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>1.00E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
GRPR


(Homo sapiens (Human))
BDBM50288236
PNG
(2-[3-(2,6-Diisopropyl-phenyl)-ureido]-N-(2,2-dimet...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(C)(Cc1c[nH]c2ccccc12)C(=O)NC1COC(C)(C)OC1
Show InChI InChI=1S/C31H42N4O4/c1-19(2)23-12-10-13-24(20(3)4)27(23)34-29(37)35-31(7,15-21-16-32-26-14-9-8-11-25(21)26)28(36)33-22-17-38-30(5,6)39-18-22/h8-14,16,19-20,22,32H,15,17-18H2,1-7H3,(H,33,36)(H2,34,35,37)
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>1.00E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
GRPR


(Homo sapiens (Human))
BDBM50288241
PNG
(CHEMBL328230 | N-Cyclohexylmethyl-2-[3-(2,6-diisop...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)N(C)CC1CCCCC1
Show InChI InChI=1S/C32H44N4O2/c1-21(2)25-15-11-16-26(22(3)4)30(25)35-32(38)34-29(18-24-19-33-28-17-10-9-14-27(24)28)31(37)36(5)20-23-12-7-6-8-13-23/h9-11,14-17,19,21-23,29,33H,6-8,12-13,18,20H2,1-5H3,(H2,34,35,38)
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>1.00E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
GRPR


(Homo sapiens (Human))
BDBM50288251
PNG
(CHEMBL87090 | N-Cyclohexyl-2-[3-(2,6-diisopropyl-p...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(C)(Cc1c[nH]c2ccccc12)C(=O)NC1CCCCC1
Show InChI InChI=1S/C31H42N4O2/c1-20(2)24-15-11-16-25(21(3)4)28(24)34-30(37)35-31(5,29(36)33-23-12-7-6-8-13-23)18-22-19-32-27-17-10-9-14-26(22)27/h9-11,14-17,19-21,23,32H,6-8,12-13,18H2,1-5H3,(H,33,36)(H2,34,35,37)
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TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
GRPR


(Homo sapiens (Human))
BDBM50288242
PNG
(2-[3-(2,6-Diisopropyl-phenyl)-ureido]-3-(1H-indol-...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(C)(Cc1c[nH]c2ccccc12)C(=O)NCCc1ccccc1
Show InChI InChI=1S/C33H40N4O2/c1-22(2)26-15-11-16-27(23(3)4)30(26)36-32(39)37-33(5,20-25-21-35-29-17-10-9-14-28(25)29)31(38)34-19-18-24-12-7-6-8-13-24/h6-17,21-23,35H,18-20H2,1-5H3,(H,34,38)(H2,36,37,39)
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TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
GRPR


(Homo sapiens (Human))
BDBM50288250
PNG
(2-[3-(2,6-Diisopropyl-phenyl)-ureido]-N-((R)-2,2-d...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(C)(Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1COC(C)(C)OC1c1ccccc1
Show InChI InChI=1S/C37H46N4O4/c1-23(2)27-17-13-18-28(24(3)4)32(27)40-35(43)41-37(7,20-26-21-38-30-19-12-11-16-29(26)30)34(42)39-31-22-44-36(5,6)45-33(31)25-14-9-8-10-15-25/h8-19,21,23-24,31,33,38H,20,22H2,1-7H3,(H,39,42)(H2,40,41,43)/t31-,33?,37?/m1/s1
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TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
GRPR


(Homo sapiens (Human))
BDBM50288245
PNG
(2-[3-(2,6-Diisopropyl-phenyl)-ureido]-3-(1H-indol-...)
Show SMILES CNC(=O)C(C)(Cc1c[nH]c2ccccc12)NC(=O)Nc1c(cccc1C(C)C)C(C)C
Show InChI InChI=1S/C26H34N4O2/c1-16(2)19-11-9-12-20(17(3)4)23(19)29-25(32)30-26(5,24(31)27-6)14-18-15-28-22-13-8-7-10-21(18)22/h7-13,15-17,28H,14H2,1-6H3,(H,27,31)(H2,29,30,32)
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TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
GRPR


(Homo sapiens (Human))
BDBM50366467
PNG
(CHEMBL1907865)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)N[C@](C)(Cc1c[nH]c2ccccc12)C(=O)NC1CCCc2ccccc12 |r|
Show InChI InChI=1S/C35H42N4O2/c1-22(2)26-16-11-17-27(23(3)4)32(26)38-34(41)39-35(5,20-25-21-36-30-18-9-8-15-29(25)30)33(40)37-31-19-10-13-24-12-6-7-14-28(24)31/h6-9,11-12,14-18,21-23,31,36H,10,13,19-20H2,1-5H3,(H,37,40)(H2,38,39,41)/t31?,35-/m1/s1
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TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
GRPR


(Homo sapiens (Human))
BDBM50288237
PNG
(CHEMBL88174 | N-Cyclohexylmethyl-2-[3-(2,6-diisopr...)
Show SMILES CC(C)c1cccc(C(C)C)c1N(C)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NCC1CCCCC1
Show InChI InChI=1S/C32H44N4O2/c1-21(2)25-15-11-16-26(22(3)4)30(25)36(5)32(38)35-29(31(37)34-19-23-12-7-6-8-13-23)18-24-20-33-28-17-10-9-14-27(24)28/h9-11,14-17,20-23,29,33H,6-8,12-13,18-19H2,1-5H3,(H,34,37)(H,35,38)
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TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
GRPR


(Homo sapiens (Human))
BDBM50288246
PNG
(2-[3-(2,6-Diisopropyl-phenyl)-ureido]-3-(1H-indol-...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(C)(Cc1c[nH]c2ccccc12)C(=O)NC1CCc2ccccc2C1
Show InChI InChI=1S/C35H42N4O2/c1-22(2)28-14-10-15-29(23(3)4)32(28)38-34(41)39-35(5,20-26-21-36-31-16-9-8-13-30(26)31)33(40)37-27-18-17-24-11-6-7-12-25(24)19-27/h6-16,21-23,27,36H,17-20H2,1-5H3,(H,37,40)(H2,38,39,41)
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TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
GRPR


(Homo sapiens (Human))
BDBM50288239
PNG
(CHEMBL315660 | N-Cyclohexylmethyl-2-[3-(2,6-diisop...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NCC1CCCCC1
Show InChI InChI=1S/C31H42N4O2/c1-20(2)24-14-10-15-25(21(3)4)29(24)35-31(37)34-28(30(36)33-18-22-11-6-5-7-12-22)17-23-19-32-27-16-9-8-13-26(23)27/h8-10,13-16,19-22,28,32H,5-7,11-12,17-18H2,1-4H3,(H,33,36)(H2,34,35,37)
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TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
GRPR


(Homo sapiens (Human))
BDBM50288243
PNG
(2-[3-(2,6-Diisopropyl-phenyl)-ureido]-3-(1H-indol-...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(C)(Cc1c[nH]c2ccccc12)C(=O)NCC1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C38H48N4O2/c1-26(2)30-18-14-19-31(27(3)4)34(30)41-36(44)42-37(5,23-28-24-39-33-20-11-10-17-32(28)33)35(43)40-25-38(21-12-7-13-22-38)29-15-8-6-9-16-29/h6,8-11,14-20,24,26-27,39H,7,12-13,21-23,25H2,1-5H3,(H,40,43)(H2,41,42,44)
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TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
GRPR


(Homo sapiens (Human))
BDBM50288249
PNG
(CHEMBL312851 | N-(1-Cyclohexyl-ethyl)-2-[3-(2,6-di...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NC(C)C1CCCCC1
Show InChI InChI=1S/C32H44N4O2/c1-20(2)25-15-11-16-26(21(3)4)30(25)36-32(38)35-29(18-24-19-33-28-17-10-9-14-27(24)28)31(37)34-22(5)23-12-7-6-8-13-23/h9-11,14-17,19-23,29,33H,6-8,12-13,18H2,1-5H3,(H,34,37)(H2,35,36,38)
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TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
GRPR


(Homo sapiens (Human))
BDBM50071754
PNG
((S)-2-[3-(2,6-Diisopropyl-phenyl)-ureido]-3-(1H-in...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)N[C@@](C)(Cc1c[nH]c2ccccc12)C(=O)NCC1(CCCCC1)c1ccccn1
Show InChI InChI=1S/C37H47N5O2/c1-25(2)28-15-13-16-29(26(3)4)33(28)41-35(44)42-36(5,22-27-23-39-31-17-8-7-14-30(27)31)34(43)40-24-37(19-10-6-11-20-37)32-18-9-12-21-38-32/h7-9,12-18,21,23,25-26,39H,6,10-11,19-20,22,24H2,1-5H3,(H,40,43)(H2,41,42,44)/t36-/m0/s1
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TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
GRPR


(Homo sapiens (Human))
BDBM50288238
PNG
(2-[3-(2,6-Diisopropyl-phenyl)-ureido]-N-((S)-2,2-d...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(C)(Cc1c[nH]c2ccccc12)C(=O)N[C@H]1COC(C)(C)OC1c1ccccc1
Show InChI InChI=1S/C37H46N4O4/c1-23(2)27-17-13-18-28(24(3)4)32(27)40-35(43)41-37(7,20-26-21-38-30-19-12-11-16-29(26)30)34(42)39-31-22-44-36(5,6)45-33(31)25-14-9-8-10-15-25/h8-19,21,23-24,31,33,38H,20,22H2,1-7H3,(H,39,42)(H2,40,41,43)/t31-,33?,37?/m0/s1
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TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
GRPR


(Homo sapiens (Human))
BDBM50288244
PNG
(CHEMBL89153 | N-Cyclohexylmethyl-2-[3-(2,6-diisopr...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC(C)(Cc1c[nH]c2ccccc12)C(=O)NCC1CCCCC1
Show InChI InChI=1S/C32H44N4O2/c1-21(2)25-15-11-16-26(22(3)4)29(25)35-31(38)36-32(5,30(37)34-19-23-12-7-6-8-13-23)18-24-20-33-28-17-10-9-14-27(24)28/h9-11,14-17,20-23,33H,6-8,12-13,18-19H2,1-5H3,(H,34,37)(H2,35,36,38)
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TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
GRPR


(Homo sapiens (Human))
BDBM50366466
PNG
(CHEMBL1907682)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)N[C@@](C)(Cc1c[nH]c2ccccc12)C(=O)NC1CCCCC1c1ccccc1 |r|
Show InChI InChI=1S/C37H46N4O2/c1-24(2)28-18-13-19-29(25(3)4)34(28)40-36(43)41-37(5,22-27-23-38-32-20-11-9-17-31(27)32)35(42)39-33-21-12-10-16-30(33)26-14-7-6-8-15-26/h6-9,11,13-15,17-20,23-25,30,33,38H,10,12,16,21-22H2,1-5H3,(H,39,42)(H2,40,41,43)/t30?,33?,37-/m0/s1
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TBA

Curated by ChEMBL


Assay Description
Binding affinity against [125 I][4Tyr]-bombesin labeled cloned human GRP(gastrin releasing peptide) receptors stably expressed in CHO cells


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair
NMB


(RAT)
BDBM50071754
PNG
((S)-2-[3-(2,6-Diisopropyl-phenyl)-ureido]-3-(1H-in...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)N[C@@](C)(Cc1c[nH]c2ccccc12)C(=O)NCC1(CCCCC1)c1ccccn1
Show InChI InChI=1S/C37H47N5O2/c1-25(2)28-15-13-16-29(26(3)4)33(28)41-35(44)42-36(5,22-27-23-39-31-17-8-7-14-30(27)31)34(43)40-24-37(19-10-6-11-20-37)32-18-9-12-21-38-32/h7-9,12-18,21,23,25-26,39H,6,10-11,19-20,22,24H2,1-5H3,(H,40,43)(H2,41,42,44)/t36-/m0/s1
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n/an/a 150n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against NMB receptor in rat olfactory bulb was determined using [125I]-[Tyr4] bombesin.


Bioorg Med Chem Lett 6: 2617-2622 (1996)


Article DOI: 10.1016/0960-894X(96)00481-7
BindingDB Entry DOI: 10.7270/Q2NC61QD
More data for this
Ligand-Target Pair