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Compile Data Set for Download or QSAR

Found 210 hits Enz. Inhib. hit(s) with Target = 'NMBR'   
Target
(Institution)
LigandTarget
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
NMBR


(HUMAN)
BDBM50071739
PNG
((S)-3-(1H-Indol-3-yl)-N-[1-(5-methoxy-pyridin-2-yl...)
Show SMILES COc1ccc(nc1)C1(CNC(=O)[C@](C)(Cc2c[nH]c3ccccc23)NC(=O)Nc2ccc(cc2)[N+]([O-])=O)CCCCC1
Show InChI InChI=1S/C32H36N6O5/c1-31(18-22-19-33-27-9-5-4-8-26(22)27,37-30(40)36-23-10-12-24(13-11-23)38(41)42)29(39)35-21-32(16-6-3-7-17-32)28-15-14-25(43-2)20-34-28/h4-5,8-15,19-20,33H,3,6-7,16-18,21H2,1-2H3,(H,35,39)(H2,36,37,40)/t31-/m0/s1
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n/an/a 0.660n/an/an/an/an/an/a



Cambridge University Forvie Site

Curated by ChEMBL


Assay Description
Antagonistic activity against labelled Bombesin receptor bb1 binding sites in rat olfactory bulb by using [125I]- [Tyr] bombesin in presence of [D-Ph...


Bioorg Med Chem Lett 8: 2589-94 (1999)

More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50158699
PNG
(CHEMBL414307 | [(N4-Bzdig)0]BB(7-14))
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)COCC(=O)Nc1ccc(CC(CNCCN)CNCCN)cc1)C(C)C)C(N)=O
Show InChI InChI=1S/C61H94N18O12S/c1-35(2)23-47(59(88)76-45(55(65)84)17-22-92-6)77-60(89)49(26-42-30-68-34-71-42)75-51(81)31-70-61(90)54(36(3)4)79-56(85)37(5)72-58(87)48(25-40-29-69-44-10-8-7-9-43(40)44)78-57(86)46(15-16-50(64)80)74-53(83)33-91-32-52(82)73-41-13-11-38(12-14-41)24-39(27-66-20-18-62)28-67-21-19-63/h7-14,29-30,34-37,39,45-49,54,66-67,69H,15-28,31-33,62-63H2,1-6H3,(H2,64,80)(H2,65,84)(H,68,71)(H,70,90)(H,72,87)(H,73,82)(H,74,83)(H,75,81)(H,76,88)(H,77,89)(H,78,86)(H,79,85)/t37-,45-,46-,47-,48-,49-,54-/m0/s1
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n/an/a 0.900n/an/an/an/an/an/a



National Center for Scientific Research Demokritos

Curated by ChEMBL


Assay Description
Inhibition of tachykinin receptor 3 expressed in human ileal carcinoid cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50158702
PNG
(CHEMBL413893 | Universal ligand)
Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](C)NC(=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](N)Cc1ccc(O)cc1)C(C)C)C(N)=O
Show InChI InChI=1S/C57H76N14O11/c1-6-7-16-42(49(60)74)66-55(80)44(25-34-13-9-8-10-14-34)69-56(81)46(27-37-29-61-30-63-37)68-50(75)32(4)65-57(82)48(31(2)3)71-51(76)33(5)64-54(79)45(26-36-28-62-41-17-12-11-15-39(36)41)70-53(78)43(22-23-47(59)73)67-52(77)40(58)24-35-18-20-38(72)21-19-35/h8-15,17-21,28-33,40,42-46,48,62,72H,6-7,16,22-27,58H2,1-5H3,(H2,59,73)(H2,60,74)(H,61,63)(H,64,79)(H,65,82)(H,66,80)(H,67,77)(H,68,75)(H,69,81)(H,70,78)(H,71,76)/t32-,33-,40-,42-,43-,44-,45-,46-,48-/m0/s1
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n/an/a 0.960n/an/an/an/an/an/a



National Center for Scientific Research Demokritos

Curated by ChEMBL


Assay Description
Inhibition of tachykinin receptor 3 expressed in human ileal carcinoid cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50158698
PNG
(CHEMBL266078 | [N40,Pro1,Tyr4]BB)
Show SMILES CSCCC[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](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)C1CCCN1C(=O)C(CNCCN)CNCCN)C(C)C)C(N)=O
Show InChI InChI=1S/C83H130N28O19S/c1-44(2)32-58(77(125)103-54(70(89)118)15-11-31-131-6)107-78(126)61(35-50-40-94-43-99-50)101-68(117)42-98-81(129)69(45(3)4)110-71(119)46(5)100-76(124)60(34-48-39-96-53-13-8-7-12-52(48)53)109-75(123)56(21-23-64(86)113)105-79(127)62(36-66(88)115)102-67(116)41-97-72(120)59(33-47-17-19-51(112)20-18-47)108-73(121)55(14-9-27-95-83(90)91)104-74(122)57(22-24-65(87)114)106-80(128)63-16-10-30-111(63)82(130)49(37-92-28-25-84)38-93-29-26-85/h7-8,12-13,17-20,39-40,43-46,49,54-63,69,92-93,96,112H,9-11,14-16,21-38,41-42,84-85H2,1-6H3,(H2,86,113)(H2,87,114)(H2,88,115)(H2,89,118)(H,94,99)(H,97,120)(H,98,129)(H,100,124)(H,101,117)(H,102,116)(H,103,125)(H,104,122)(H,105,127)(H,106,128)(H,107,126)(H,108,121)(H,109,123)(H,110,119)(H4,90,91,95)/t46-,54-,55-,56-,57-,58-,59-,60-,61-,62-,63?,69-/m0/s1
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n/an/a 1.60n/an/an/an/an/an/a



National Center for Scientific Research Demokritos

Curated by ChEMBL


Assay Description
Inhibition of tachykinin receptor 3 expressed in human ileal carcinoid cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50158700
PNG
(CHEMBL266079 | [(N4-Bzdig)0,Nle14]BB(7-14))
Show SMILES CCCC[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)COCC(=O)Nc1ccc(CC(CNCCN)CNCCN)cc1)C(C)C)C(N)=O
Show InChI InChI=1S/C62H96N18O12/c1-7-8-12-46(56(66)85)77-60(89)48(24-36(2)3)78-61(90)50(27-43-31-69-35-72-43)76-52(82)32-71-62(91)55(37(4)5)80-57(86)38(6)73-59(88)49(26-41-30-70-45-13-10-9-11-44(41)45)79-58(87)47(18-19-51(65)81)75-54(84)34-92-33-53(83)74-42-16-14-39(15-17-42)25-40(28-67-22-20-63)29-68-23-21-64/h9-11,13-17,30-31,35-38,40,46-50,55,67-68,70H,7-8,12,18-29,32-34,63-64H2,1-6H3,(H2,65,81)(H2,66,85)(H,69,72)(H,71,91)(H,73,88)(H,74,83)(H,75,84)(H,76,82)(H,77,89)(H,78,90)(H,79,87)(H,80,86)/t38-,46-,47-,48-,49-,50-,55-/m0/s1
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n/an/a 2n/an/an/an/an/an/a



National Center for Scientific Research Demokritos

Curated by ChEMBL


Assay Description
Inhibition of tachykinin receptor 3 expressed in human ileal carcinoid cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50158697
PNG
(CHEMBL268222 | [N40,Pro1,Tyr4,Nle 14]BB)
Show SMILES CCCCC[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](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)C1CCCN1C(=O)C(CNCCN)CNCCN)C(C)C)C(N)=O
Show InChI InChI=1S/C84H132N28O19/c1-7-8-9-16-55(71(90)119)104-78(126)59(33-45(2)3)108-79(127)62(36-51-41-95-44-100-51)102-69(118)43-99-82(130)70(46(4)5)111-72(120)47(6)101-77(125)61(35-49-40-97-54-15-11-10-14-53(49)54)110-76(124)57(23-25-65(87)114)106-80(128)63(37-67(89)116)103-68(117)42-98-73(121)60(34-48-19-21-52(113)22-20-48)109-74(122)56(17-12-29-96-84(91)92)105-75(123)58(24-26-66(88)115)107-81(129)64-18-13-32-112(64)83(131)50(38-93-30-27-85)39-94-31-28-86/h10-11,14-15,19-22,40-41,44-47,50,55-64,70,93-94,97,113H,7-9,12-13,16-18,23-39,42-43,85-86H2,1-6H3,(H2,87,114)(H2,88,115)(H2,89,116)(H2,90,119)(H,95,100)(H,98,121)(H,99,130)(H,101,125)(H,102,118)(H,103,117)(H,104,126)(H,105,123)(H,106,128)(H,107,129)(H,108,127)(H,109,122)(H,110,124)(H,111,120)(H4,91,92,96)/t47-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64?,70-/m0/s1
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n/an/a 11.2n/an/an/an/an/an/a



National Center for Scientific Research Demokritos

Curated by ChEMBL


Assay Description
Inhibition of tachykinin receptor 3 expressed in human ileal carcinoid cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50147019
PNG
(3-[3-(2,6-Diisopropyl-phenyl)-ureido]-5-methoxy-2,...)
Show SMILES COc1cccc2[nH]c3CCC(Cc3c12)(NC(=O)Nc1c(cccc1C(C)C)C(C)C)C(=O)NCC1(CCCCC1)c1ccccn1
Show InChI InChI=1S/C39H49N5O3/c1-25(2)27-13-11-14-28(26(3)4)35(27)43-37(46)44-39(21-18-30-29(23-39)34-31(42-30)15-12-16-32(34)47-5)36(45)41-24-38(19-8-6-9-20-38)33-17-7-10-22-40-33/h7,10-17,22,25-26,42H,6,8-9,18-21,23-24H2,1-5H3,(H,41,45)(H2,43,44,46)
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n/an/a 29n/an/an/an/an/an/a



Tularik Inc.

Curated by ChEMBL


Assay Description
Affinity of [125I]-[D-Tyr0]-NMB to human Neuromedin B receptor expressed in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295231
PNG
((+)-8'-methyl-11'-(2-(trifluoromethyl)phenyl)-4',5...)
Show SMILES Cc1ccc2N=C3CC4(CCCC4)CC(=O)C3C(Nc2c1)c1ccccc1C(F)(F)F
Show InChI InChI=1S/C25H25F3N2O/c1-15-8-9-18-19(12-15)30-23(16-6-2-3-7-17(16)25(26,27)28)22-20(29-18)13-24(14-21(22)31)10-4-5-11-24/h2-3,6-9,12,22-23,30H,4-5,10-11,13-14H2,1H3
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n/an/a 30n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295231
PNG
((+)-8'-methyl-11'-(2-(trifluoromethyl)phenyl)-4',5...)
Show SMILES Cc1ccc2N=C3CC4(CCCC4)CC(=O)C3C(Nc2c1)c1ccccc1C(F)(F)F
Show InChI InChI=1S/C25H25F3N2O/c1-15-8-9-18-19(12-15)30-23(16-6-2-3-7-17(16)25(26,27)28)22-20(29-18)13-24(14-21(22)31)10-4-5-11-24/h2-3,6-9,12,22-23,30H,4-5,10-11,13-14H2,1H3
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n/an/a 96n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295222
PNG
(10-butyl-11-(2-chloro-6-fluorophenyl)-3,3,8-trimet...)
Show SMILES CCCCN1C(C2C(=O)CC(C)(C)CC2=Nc2ccc(C)cc12)c1c(F)cccc1Cl
Show InChI InChI=1S/C26H30ClFN2O/c1-5-6-12-30-21-13-16(2)10-11-19(21)29-20-14-26(3,4)15-22(31)24(20)25(30)23-17(27)8-7-9-18(23)28/h7-11,13,24-25H,5-6,12,14-15H2,1-4H3
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n/an/a 150n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295254
PNG
(11-(2-chloro-6-fluorophenyl)-3,3,8,10-tetramethyl-...)
Show SMILES CN1C(C2C(=O)CC(C)(C)CC2=Nc2ccc(C)cc12)c1c(F)cccc1Cl
Show InChI InChI=1S/C23H24ClFN2O/c1-13-8-9-16-18(10-13)27(4)22(20-14(24)6-5-7-15(20)25)21-17(26-16)11-23(2,3)12-19(21)28/h5-10,21-22H,11-12H2,1-4H3
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n/an/a 170n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295221
PNG
(11-(2-chloro-6-fluorophenyl)-10-ethyl-3,3,8-trimet...)
Show SMILES CCN1C(C2C(=O)CC(C)(C)CC2=Nc2ccc(C)cc12)c1c(F)cccc1Cl
Show InChI InChI=1S/C24H26ClFN2O/c1-5-28-19-11-14(2)9-10-17(19)27-18-12-24(3,4)13-20(29)22(18)23(28)21-15(25)7-6-8-16(21)26/h6-11,22-23H,5,12-13H2,1-4H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295245
PNG
(3,3,8-trimethyl-11-(2-(methylthio)phenyl)-2,3,4,5,...)
Show SMILES CSc1ccccc1C1Nc2cc(C)ccc2N=C2CC(C)(C)CC(=O)C12
Show InChI InChI=1S/C23H26N2OS/c1-14-9-10-16-17(11-14)25-22(15-7-5-6-8-20(15)27-4)21-18(24-16)12-23(2,3)13-19(21)26/h5-11,21-22,25H,12-13H2,1-4H3
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n/an/a 200n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295232
PNG
(11'-(2-chlorophenyl)-8'-methyl-4',5',10',11'-tetra...)
Show SMILES Cc1ccc2N=C3CC4(CCCC4)CC(=O)C3C(Nc2c1)c1ccccc1Cl
Show InChI InChI=1S/C24H25ClN2O/c1-15-8-9-18-19(12-15)27-23(16-6-2-3-7-17(16)25)22-20(26-18)13-24(14-21(22)28)10-4-5-11-24/h2-3,6-9,12,22-23,27H,4-5,10-11,13-14H2,1H3
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n/an/a 240n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295233
PNG
(8'-methyl-11'-(2-(methylthio)phenyl)-4',5',10',11'...)
Show SMILES CSc1ccccc1C1Nc2cc(C)ccc2N=C2CC3(CCCC3)CC(=O)C12
Show InChI InChI=1S/C25H28N2OS/c1-16-9-10-18-19(13-16)27-24(17-7-3-4-8-22(17)29-2)23-20(26-18)14-25(15-21(23)28)11-5-6-12-25/h3-4,7-10,13,23-24,27H,5-6,11-12,14-15H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295246
PNG
(3,3,8-trimethyl-11-(2-(trifluoromethyl)phenyl)-2,3...)
Show SMILES Cc1ccc2N=C3CC(C)(C)CC(=O)C3C(Nc2c1)c1ccccc1C(F)(F)F
Show InChI InChI=1S/C23H23F3N2O/c1-13-8-9-16-17(10-13)28-21(14-6-4-5-7-15(14)23(24,25)26)20-18(27-16)11-22(2,3)12-19(20)29/h4-10,20-21,28H,11-12H2,1-3H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50147019
PNG
(3-[3-(2,6-Diisopropyl-phenyl)-ureido]-5-methoxy-2,...)
Show SMILES COc1cccc2[nH]c3CCC(Cc3c12)(NC(=O)Nc1c(cccc1C(C)C)C(C)C)C(=O)NCC1(CCCCC1)c1ccccn1
Show InChI InChI=1S/C39H49N5O3/c1-25(2)27-13-11-14-28(26(3)4)35(27)43-37(46)44-39(21-18-30-29(23-39)34-31(42-30)15-12-16-32(34)47-5)36(45)41-24-38(19-8-6-9-20-38)33-17-7-10-22-40-33/h7,10-17,22,25-26,42H,6,8-9,18-21,23-24H2,1-5H3,(H,41,45)(H2,43,44,46)
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Tularik Inc.

Curated by ChEMBL


Assay Description
Affinity of [125I]-[D-Tyr0]-NMB to human Neuromedin B receptor expressed in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295223
PNG
(11'-(2-chloro-6-fluorophenyl)-8'-methyl-4',5',10',...)
Show SMILES Cc1ccc2N=C3CC4(CCCC4)CC(=O)C3C(Nc2c1)c1c(F)cccc1Cl
Show InChI InChI=1S/C24H24ClFN2O/c1-14-7-8-17-18(11-14)28-23(21-15(25)5-4-6-16(21)26)22-19(27-17)12-24(13-20(22)29)9-2-3-10-24/h4-8,11,22-23,28H,2-3,9-10,12-13H2,1H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295247
PNG
(11-(2-chlorophenyl)-3,3,8-trimethyl-2,3,4,5,10,11-...)
Show SMILES Cc1ccc2N=C3CC(C)(C)CC(=O)C3C(Nc2c1)c1ccccc1Cl
Show InChI InChI=1S/C22H23ClN2O/c1-13-8-9-16-17(10-13)25-21(14-6-4-5-7-15(14)23)20-18(24-16)11-22(2,3)12-19(20)26/h4-10,20-21,25H,11-12H2,1-3H3
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n/an/a 280n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295236
PNG
(11-(2-chloro-6-fluorophenyl)-3,3,8-trimethyl-2,3,4...)
Show SMILES Cc1ccc2N=C3CC(C)(C)CC(=O)C3C(Nc2c1)c1c(F)cccc1Cl
Show InChI InChI=1S/C22H22ClFN2O/c1-12-7-8-15-16(9-12)26-21(19-13(23)5-4-6-14(19)24)20-17(25-15)10-22(2,3)11-18(20)27/h4-9,20-21,26H,10-11H2,1-3H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50147021
PNG
(3-[3-(2,6-Diisopropyl-phenyl)-ureido]-2,3,4,9-tetr...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC1(CCc2[nH]c3ccccc3c2C1)C(=O)NCC1(CCCCC1)c1ccccn1
Show InChI InChI=1S/C38H47N5O2/c1-25(2)27-14-12-15-28(26(3)4)34(27)42-36(45)43-38(21-18-32-30(23-38)29-13-6-7-16-31(29)41-32)35(44)40-24-37(19-9-5-10-20-37)33-17-8-11-22-39-33/h6-8,11-17,22,25-26,41H,5,9-10,18-21,23-24H2,1-4H3,(H,40,44)(H2,42,43,45)
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Tularik Inc.

Curated by ChEMBL


Assay Description
Affinity of [125I]-[D-Tyr0]-NMB to human Neuromedin B receptor expressed in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(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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Tularik Inc.

Curated by ChEMBL


Assay Description
Affinity of [125I]-[D-Tyr0]-NMB to human Neuromedin B receptor expressed in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295237
PNG
(11-(2-chloro-6-fluorophenyl)-3,3-dimethyl-8-(trifl...)
Show SMILES CC1(C)CC(=O)C2C(Nc3cc(ccc3N=C2C1)C(F)(F)F)c1c(F)cccc1Cl
Show InChI InChI=1S/C22H19ClF4N2O/c1-21(2)9-16-19(17(30)10-21)20(18-12(23)4-3-5-13(18)24)29-15-8-11(22(25,26)27)6-7-14(15)28-16/h3-8,19-20,29H,9-10H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295224
PNG
(11-(2-chloro-6-fluorophenyl)-3,8-dimethyl-2,3,4,5,...)
Show SMILES CC1CC(=O)C2C(Nc3cc(C)ccc3N=C2C1)c1c(F)cccc1Cl
Show InChI InChI=1S/C21H20ClFN2O/c1-11-6-7-15-16(8-11)25-21(19-13(22)4-3-5-14(19)23)20-17(24-15)9-12(2)10-18(20)26/h3-8,12,20-21,25H,9-10H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295234
PNG
(11'-(2-fluoro-6-(trifluoromethyl)phenyl)-8'-methyl...)
Show SMILES Cc1ccc2N=C3CC4(CCCC4)CC(=O)C3C(Nc2c1)c1c(F)cccc1C(F)(F)F
Show InChI InChI=1S/C25H24F4N2O/c1-14-7-8-17-18(11-14)31-23(21-15(25(27,28)29)5-4-6-16(21)26)22-19(30-17)12-24(13-20(22)32)9-2-3-10-24/h4-8,11,22-23,31H,2-3,9-10,12-13H2,1H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295248
PNG
(3,3,8-trimethyl-11-(2-nitrophenyl)-2,3,4,5,10,11-h...)
Show SMILES Cc1ccc2N=C3CC(C)(C)CC(=O)C3C(Nc2c1)c1ccccc1[N+]([O-])=O
Show InChI InChI=1S/C22H23N3O3/c1-13-8-9-15-16(10-13)24-21(14-6-4-5-7-18(14)25(27)28)20-17(23-15)11-22(2,3)12-19(20)26/h4-10,20-21,24H,11-12H2,1-3H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295231
PNG
((+)-8'-methyl-11'-(2-(trifluoromethyl)phenyl)-4',5...)
Show SMILES Cc1ccc2N=C3CC4(CCCC4)CC(=O)C3C(Nc2c1)c1ccccc1C(F)(F)F
Show InChI InChI=1S/C25H25F3N2O/c1-15-8-9-18-19(12-15)30-23(16-6-2-3-7-17(16)25(26,27)28)22-20(29-18)13-24(14-21(22)31)10-4-5-11-24/h2-3,6-9,12,22-23,30H,4-5,10-11,13-14H2,1H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human neuromedin B receptor transfected in HEK293 cells assessed as inhibition of 1 nM neuromedin B-induced myo-[3H]inositol p...


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50147035
PNG
(3-[3-(2-Methyl-4-nitro-phenyl)-ureido]-2,3,4,9-tet...)
Show SMILES Cc1cc(ccc1NC(=O)NC1(CCc2[nH]c3ccccc3c2C1)C(=O)NCC1(CCCCC1)c1ccccn1)[N+]([O-])=O
Show InChI InChI=1S/C33H36N6O4/c1-22-19-23(39(42)43)12-13-26(22)37-31(41)38-33(17-14-28-25(20-33)24-9-3-4-10-27(24)36-28)30(40)35-21-32(15-6-2-7-16-32)29-11-5-8-18-34-29/h3-5,8-13,18-19,36H,2,6-7,14-17,20-21H2,1H3,(H,35,40)(H2,37,38,41)
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Tularik Inc.

Curated by ChEMBL


Assay Description
Affinity of [125I]-[D-Tyr0]-NMB to human Neuromedin B receptor expressed in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295235
PNG
(8'-methyl-11'-(2-(trifluoromethylthio)phenyl)-4',5...)
Show SMILES Cc1ccc2N=C3CC4(CCCC4)CC(=O)C3C(Nc2c1)c1ccccc1SC(F)(F)F
Show InChI InChI=1S/C25H25F3N2OS/c1-15-8-9-17-18(12-15)30-23(16-6-2-3-7-21(16)32-25(26,27)28)22-19(29-17)13-24(14-20(22)31)10-4-5-11-24/h2-3,6-9,12,22-23,30H,4-5,10-11,13-14H2,1H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50147043
PNG
(3-[3-(2,6-Diisopropyl-phenyl)-ureido]-5-methyl-2,3...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC1(CCc2[nH]c3cccc(C)c3c2C1)C(=O)NCC1(CCCCC1)c1ccccn1
Show InChI InChI=1S/C39H49N5O2/c1-25(2)28-14-12-15-29(26(3)4)35(28)43-37(46)44-39(21-18-31-30(23-39)34-27(5)13-11-16-32(34)42-31)36(45)41-24-38(19-8-6-9-20-38)33-17-7-10-22-40-33/h7,10-17,22,25-26,42H,6,8-9,18-21,23-24H2,1-5H3,(H,41,45)(H2,43,44,46)
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Tularik Inc.

Curated by ChEMBL


Assay Description
Affinity of [125I]-[D-Tyr0]-NMB to human Neuromedin B receptor expressed in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50147036
PNG
(3-[3-(2,6-Diisopropyl-phenyl)-ureido]-4,6-dimethyl...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC1(CCc2[nH]c3ccc(C)cc3c2C1C)C(=O)NCC1(CCCCC1)c1ccccn1
Show InChI InChI=1S/C40H51N5O2/c1-25(2)29-13-12-14-30(26(3)4)36(29)44-38(47)45-40(21-18-33-35(28(40)6)31-23-27(5)16-17-32(31)43-33)37(46)42-24-39(19-9-7-10-20-39)34-15-8-11-22-41-34/h8,11-17,22-23,25-26,28,43H,7,9-10,18-21,24H2,1-6H3,(H,42,46)(H2,44,45,47)
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Tularik Inc.

Curated by ChEMBL


Assay Description
Affinity of [125I]-[D-Tyr0]-NMB to human Neuromedin B receptor expressed in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50147036
PNG
(3-[3-(2,6-Diisopropyl-phenyl)-ureido]-4,6-dimethyl...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC1(CCc2[nH]c3ccc(C)cc3c2C1C)C(=O)NCC1(CCCCC1)c1ccccn1
Show InChI InChI=1S/C40H51N5O2/c1-25(2)29-13-12-14-30(26(3)4)36(29)44-38(47)45-40(21-18-33-35(28(40)6)31-23-27(5)16-17-32(31)43-33)37(46)42-24-39(19-9-7-10-20-39)34-15-8-11-22-41-34/h8,11-17,22-23,25-26,28,43H,7,9-10,18-21,24H2,1-6H3,(H,42,46)(H2,44,45,47)
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Tularik Inc.

Curated by ChEMBL


Assay Description
Affinity of [125I]-[D-Tyr0]-NMB to human Neuromedin B receptor expressed in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50147031
PNG
(3-[3-(4-Nitro-phenyl)-ureido]-2,3,4,9-tetrahydro-1...)
Show SMILES [O-][N+](=O)c1ccc(NC(=O)NC2(CCc3[nH]c4ccccc4c3C2)C(=O)NCC2(CCCCC2)c2ccccn2)cc1
Show InChI InChI=1S/C32H34N6O4/c39-29(34-21-31(16-5-1-6-17-31)28-10-4-7-19-33-28)32(37-30(40)35-22-11-13-23(14-12-22)38(41)42)18-15-27-25(20-32)24-8-2-3-9-26(24)36-27/h2-4,7-14,19,36H,1,5-6,15-18,20-21H2,(H,34,39)(H2,35,37,40)
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Tularik Inc.

Curated by ChEMBL


Assay Description
Affinity of [125I]-[D-Tyr0]-NMB to human Neuromedin B receptor expressed in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295225
PNG
(11-(2-chloro-6-fluorophenyl)-3-isopropyl-8-methyl-...)
Show SMILES CC(C)C1CC(=O)C2C(Nc3cc(C)ccc3N=C2C1)c1c(F)cccc1Cl
Show InChI InChI=1S/C23H24ClFN2O/c1-12(2)14-10-19-22(20(28)11-14)23(21-15(24)5-4-6-16(21)25)27-18-9-13(3)7-8-17(18)26-19/h4-9,12,14,22-23,27H,10-11H2,1-3H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295238
PNG
(8-chloro-11-(2-chloro-6-fluorophenyl)-3,3-dimethyl...)
Show SMILES CC1(C)CC(=O)C2C(Nc3cc(Cl)ccc3N=C2C1)c1c(F)cccc1Cl
Show InChI InChI=1S/C21H19Cl2FN2O/c1-21(2)9-16-19(17(27)10-21)20(18-12(23)4-3-5-13(18)24)26-15-8-11(22)6-7-14(15)25-16/h3-8,19-20,26H,9-10H2,1-2H3
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Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50147023
PNG
(3-[3-(2,6-Diisopropyl-phenyl)-ureido]-4,7-difluoro...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC1(CCc2[nH]c3cc(F)ccc3c2C1F)C(=O)NCC1(CCCCC1)c1ccccn1
Show InChI InChI=1S/C38H45F2N5O2/c1-23(2)26-11-10-12-27(24(3)4)33(26)44-36(47)45-38(19-16-29-32(34(38)40)28-15-14-25(39)21-30(28)43-29)35(46)42-22-37(17-7-5-8-18-37)31-13-6-9-20-41-31/h6,9-15,20-21,23-24,34,43H,5,7-8,16-19,22H2,1-4H3,(H,42,46)(H2,44,45,47)
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n/an/a 1.01E+3n/an/an/an/an/an/a



Tularik Inc.

Curated by ChEMBL


Assay Description
Affinity of [125I]-[D-Tyr0]-NMB to human Neuromedin B receptor expressed in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295249
PNG
(11-(2-methoxyphenyl)-3,3,8-trimethyl-2,3,4,5,10,11...)
Show SMILES COc1ccccc1C1Nc2cc(C)ccc2N=C2CC(C)(C)CC(=O)C12
Show InChI InChI=1S/C23H26N2O2/c1-14-9-10-16-17(11-14)25-22(15-7-5-6-8-20(15)27-4)21-18(24-16)12-23(2,3)13-19(21)26/h5-11,21-22,25H,12-13H2,1-4H3
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n/an/a 1.10E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50147041
PNG
(3-[3-(4-Trifluoromethyl-phenyl)-ureido]-2,3,4,9-te...)
Show SMILES FC(F)(F)c1ccc(NC(=O)NC2(CCc3[nH]c4ccccc4c3C2)C(=O)NCC2(CCCCC2)c2ccccn2)cc1
Show InChI InChI=1S/C33H34F3N5O2/c34-33(35,36)22-11-13-23(14-12-22)39-30(43)41-32(18-15-27-25(20-32)24-8-2-3-9-26(24)40-27)29(42)38-21-31(16-5-1-6-17-31)28-10-4-7-19-37-28/h2-4,7-14,19,40H,1,5-6,15-18,20-21H2,(H,38,42)(H2,39,41,43)
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n/an/a 1.11E+3n/an/an/an/an/an/a



Tularik Inc.

Curated by ChEMBL


Assay Description
Affinity of [125I]-[D-Tyr0]-NMB to human Neuromedin B receptor expressed in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295250
PNG
(11-(2-fluorophenyl)-3,3,8-trimethyl-2,3,4,5,10,11-...)
Show SMILES Cc1ccc2N=C3CC(C)(C)CC(=O)C3C(Nc2c1)c1ccccc1F
Show InChI InChI=1S/C22H23FN2O/c1-13-8-9-16-17(10-13)25-21(14-6-4-5-7-15(14)23)20-18(24-16)11-22(2,3)12-19(20)26/h4-10,20-21,25H,11-12H2,1-3H3
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n/an/a 1.30E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295239
PNG
(11-(2-chloro-6-fluorophenyl)-3,3-dimethyl-8-(trifl...)
Show SMILES CC1(C)CC(=O)C2C(Nc3cc(OC(F)(F)F)ccc3N=C2C1)c1c(F)cccc1Cl
Show InChI InChI=1S/C22H19ClF4N2O2/c1-21(2)9-16-19(17(30)10-21)20(18-12(23)4-3-5-13(18)24)29-15-8-11(31-22(25,26)27)6-7-14(15)28-16/h3-8,19-20,29H,9-10H2,1-2H3
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n/an/a 1.30E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295240
PNG
(11-(2-chloro-6-fluorophenyl)-3,3-dimethyl-1-oxo-2,...)
Show SMILES CC1(C)CC(=O)C2C(Nc3cc(ccc3N=C2C1)C#N)c1c(F)cccc1Cl
Show InChI InChI=1S/C22H19ClFN3O/c1-22(2)9-17-20(18(28)10-22)21(19-13(23)4-3-5-14(19)24)27-16-8-12(11-25)6-7-15(16)26-17/h3-8,20-21,27H,9-10H2,1-2H3
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n/an/a 1.30E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295226
PNG
(11-(2-chloro-6-fluorophenyl)-8-methyl-2,3,4,5,10,1...)
Show SMILES Cc1ccc2N=C3CCCC(=O)C3C(Nc2c1)c1c(F)cccc1Cl
Show InChI InChI=1S/C20H18ClFN2O/c1-11-8-9-14-16(10-11)24-20(18-12(21)4-2-5-13(18)22)19-15(23-14)6-3-7-17(19)25/h2,4-5,8-10,19-20,24H,3,6-7H2,1H3
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n/an/a 1.40E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50147029
PNG
(5-(3-{3-[(1-Pyridin-2-yl-cyclohexylmethyl)-carbamo...)
Show SMILES CCOC(=O)c1cc(NC(=O)NC2(CCc3[nH]c4ccccc4c3C2)C(=O)NCC2(CCCCC2)c2ccccn2)cc(c1)C(=O)OCC
Show InChI InChI=1S/C38H43N5O6/c1-3-48-33(44)25-20-26(34(45)49-4-2)22-27(21-25)41-36(47)43-38(18-15-31-29(23-38)28-12-6-7-13-30(28)42-31)35(46)40-24-37(16-9-5-10-17-37)32-14-8-11-19-39-32/h6-8,11-14,19-22,42H,3-5,9-10,15-18,23-24H2,1-2H3,(H,40,46)(H2,41,43,47)
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n/an/a 1.85E+3n/an/an/an/an/an/a



Tularik Inc.

Curated by ChEMBL


Assay Description
Affinity of [125I]-[D-Tyr0]-NMB to human Neuromedin B receptor expressed in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50147040
PNG
(3-[3-(2,6-Diisopropyl-phenyl)-ureido]-5-trifluorom...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC1(CCc2[nH]c3cccc(OC(F)(F)F)c3c2C1)C(=O)NCC1(CCCCC1)c1ccccn1
Show InChI InChI=1S/C39H46F3N5O3/c1-24(2)26-12-10-13-27(25(3)4)34(26)46-36(49)47-38(35(48)44-23-37(18-7-5-8-19-37)32-16-6-9-21-43-32)20-17-29-28(22-38)33-30(45-29)14-11-15-31(33)50-39(40,41)42/h6,9-16,21,24-25,45H,5,7-8,17-20,22-23H2,1-4H3,(H,44,48)(H2,46,47,49)
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n/an/a 1.89E+3n/an/an/an/an/an/a



Tularik Inc.

Curated by ChEMBL


Assay Description
Affinity of [125I]-[D-Tyr0]-NMB to human Neuromedin B receptor expressed in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295227
PNG
(11-(2-chloro-6-fluorophenyl)-3-(4-methoxyphenyl)-8...)
Show SMILES COc1ccc(cc1)C1CC(=O)C2C(Nc3cc(C)ccc3N=C2C1)c1c(F)cccc1Cl
Show InChI InChI=1S/C27H24ClFN2O2/c1-15-6-11-21-22(12-15)31-27(25-19(28)4-3-5-20(25)29)26-23(30-21)13-17(14-24(26)32)16-7-9-18(33-2)10-8-16/h3-12,17,26-27,31H,13-14H2,1-2H3
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n/an/a 2.00E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50147028
PNG
(7-Bromo-3-[3-(2,6-diisopropyl-phenyl)-ureido]-2,3,...)
Show SMILES CC(C)c1cccc(C(C)C)c1NC(=O)NC1(CCc2[nH]c3cc(Br)ccc3c2C1)C(=O)NCC1(CCCCC1)c1ccccn1
Show InChI InChI=1S/C38H46BrN5O2/c1-24(2)27-11-10-12-28(25(3)4)34(27)43-36(46)44-38(19-16-31-30(22-38)29-15-14-26(39)21-32(29)42-31)35(45)41-23-37(17-7-5-8-18-37)33-13-6-9-20-40-33/h6,9-15,20-21,24-25,42H,5,7-8,16-19,22-23H2,1-4H3,(H,41,45)(H2,43,44,46)
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n/an/a 2.14E+3n/an/an/an/an/an/a



Tularik Inc.

Curated by ChEMBL


Assay Description
Affinity of [125I]-[D-Tyr0]-NMB to human Neuromedin B receptor expressed in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295241
PNG
(11-(2-chloro-6-fluorophenyl)-8-methoxy-3,3-dimethy...)
Show SMILES COc1ccc2N=C3CC(C)(C)CC(=O)C3C(Nc2c1)c1c(F)cccc1Cl
Show InChI InChI=1S/C22H22ClFN2O2/c1-22(2)10-17-20(18(27)11-22)21(19-13(23)5-4-6-14(19)24)26-16-9-12(28-3)7-8-15(16)25-17/h4-9,20-21,26H,10-11H2,1-3H3
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n/an/a 2.20E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50147020
PNG
(3-[3-(3-Acetyl-phenyl)-ureido]-2,3,4,9-tetrahydro-...)
Show SMILES CC(=O)c1cccc(NC(=O)NC2(CCc3[nH]c4ccccc4c3C2)C(=O)NCC2(CCCCC2)c2ccccn2)c1
Show InChI InChI=1S/C34H37N5O3/c1-23(40)24-10-9-11-25(20-24)37-32(42)39-34(18-15-29-27(21-34)26-12-3-4-13-28(26)38-29)31(41)36-22-33(16-6-2-7-17-33)30-14-5-8-19-35-30/h3-5,8-14,19-20,38H,2,6-7,15-18,21-22H2,1H3,(H,36,41)(H2,37,39,42)
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n/an/a 2.27E+3n/an/an/an/an/an/a



Tularik Inc.

Curated by ChEMBL


Assay Description
Affinity of [125I]-[D-Tyr0]-NMB to human Neuromedin B receptor expressed in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295251
PNG
(11-(2,6-difluorophenyl)-3,3,8-trimethyl-2,3,4,5,10...)
Show SMILES Cc1ccc2N=C3CC(C)(C)CC(=O)C3C(Nc2c1)c1c(F)cccc1F
Show InChI InChI=1S/C22H22F2N2O/c1-12-7-8-15-16(9-12)26-21(19-13(23)5-4-6-14(19)24)20-17(25-15)10-22(2,3)11-18(20)27/h4-9,20-21,26H,10-11H2,1-3H3
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n/an/a 2.50E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
NMBR


(HUMAN)
BDBM50295228
PNG
(11-(2-chloro-6-fluorophenyl)-3-(furan-2-yl)-8-meth...)
Show SMILES Cc1ccc2N=C3CC(CC(=O)C3C(Nc2c1)c1c(F)cccc1Cl)c1ccco1
Show InChI InChI=1S/C24H20ClFN2O2/c1-13-7-8-17-18(10-13)28-24(22-15(25)4-2-5-16(22)26)23-19(27-17)11-14(12-20(23)29)21-6-3-9-30-21/h2-10,14,23-24,28H,11-12H2,1H3
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n/an/a 3.00E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-(D-Tyr0)NMB from human neuromedin B receptor transfected in HEK293 cells


Citation and Details
More data for this
Ligand-Target Pair
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