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287 similar compounds to monomer 50114083

Compile data set for download or QSAR
Wt: 755.9
BDBM81890
Wt: 1106.2
BDBM86500
Wt: 1133.3
BDBM86502
Wt: 830.0
BDBM86303
Wt: 1521.7
BDBM85479
Wt: 1101.3
BDBM85480
Wt: 1040.2
BDBM85482
Wt: 1117.3
BDBM85488
Wt: 1024.1
BDBM85490
Wt: 1042.2
BDBM85493
Wt: 956.1
BDBM85494
Wt: 998.1
BDBM85495
Wt: 971.1
BDBM85501
Wt: 1039.1
BDBM135621
Wt: 1067.2
BDBM135616
Displayed 1 to 15 (of 287 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 63 hits for monomerid = 81890,85479,85480,85482,85488,85490,85493,85494,85495,85501,86303,86500,86502,135616,135621   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Gastrin releasing peptide receptor


(MOUSE)
BDBM85488
PNG
(DPhe6,BetaAla11,Phe13,Nle14-Bn(6-14))
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)Cc1ccccc1)C(C)C)C(N)=O
Show InChI InChI=1S/C57H76N14O10/c1-6-7-21-42(49(60)73)66-55(79)44(26-36-18-12-9-13-19-36)69-56(80)46(28-38-30-61-31-63-38)68-50(74)33(4)65-57(81)48(32(2)3)71-51(75)34(5)64-54(78)45(27-37-29-62-41-22-15-14-20-39(37)41)70-53(77)43(23-24-47(59)72)67-52(76)40(58)25-35-16-10-8-11-17-35/h8-20,22,29-34,40,42-46,48,62H,6-7,21,23-28,58H2,1-5H3,(H2,59,72)(H2,60,73)(H,61,63)(H,64,78)(H,65,81)(H,66,79)(H,67,76)(H,68,74)(H,69,80)(H,70,77)(H,71,75)/t33-,34-,40+,42-,43-,44-,45-,46-,48-/m0/s1
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0.110n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Gastrin releasing peptide receptor


(MOUSE)
BDBM85488
PNG
(DPhe6,BetaAla11,Phe13,Nle14-Bn(6-14))
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)Cc1ccccc1)C(C)C)C(N)=O
Show InChI InChI=1S/C57H76N14O10/c1-6-7-21-42(49(60)73)66-55(79)44(26-36-18-12-9-13-19-36)69-56(80)46(28-38-30-61-31-63-38)68-50(74)33(4)65-57(81)48(32(2)3)71-51(75)34(5)64-54(78)45(27-37-29-62-41-22-15-14-20-39(37)41)70-53(77)43(23-24-47(59)72)67-52(76)40(58)25-35-16-10-8-11-17-35/h8-20,22,29-34,40,42-46,48,62H,6-7,21,23-28,58H2,1-5H3,(H2,59,72)(H2,60,73)(H,61,63)(H,64,78)(H,65,81)(H,66,79)(H,67,76)(H,68,74)(H,69,80)(H,70,77)(H,71,75)/t33-,34-,40+,42-,43-,44-,45-,46-,48-/m0/s1
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0.190n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Gastrin releasing peptide receptor


(MOUSE)
BDBM85488
PNG
(DPhe6,BetaAla11,Phe13,Nle14-Bn(6-14))
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)Cc1ccccc1)C(C)C)C(N)=O
Show InChI InChI=1S/C57H76N14O10/c1-6-7-21-42(49(60)73)66-55(79)44(26-36-18-12-9-13-19-36)69-56(80)46(28-38-30-61-31-63-38)68-50(74)33(4)65-57(81)48(32(2)3)71-51(75)34(5)64-54(78)45(27-37-29-62-41-22-15-14-20-39(37)41)70-53(77)43(23-24-47(59)72)67-52(76)40(58)25-35-16-10-8-11-17-35/h8-20,22,29-34,40,42-46,48,62H,6-7,21,23-28,58H2,1-5H3,(H2,59,72)(H2,60,73)(H,61,63)(H,64,78)(H,65,81)(H,66,79)(H,67,76)(H,68,74)(H,69,80)(H,70,77)(H,71,75)/t33-,34-,40+,42-,43-,44-,45-,46-,48-/m0/s1
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0.240n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Gastrin releasing peptide receptor


(MOUSE)
BDBM85488
PNG
(DPhe6,BetaAla11,Phe13,Nle14-Bn(6-14))
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)Cc1ccccc1)C(C)C)C(N)=O
Show InChI InChI=1S/C57H76N14O10/c1-6-7-21-42(49(60)73)66-55(79)44(26-36-18-12-9-13-19-36)69-56(80)46(28-38-30-61-31-63-38)68-50(74)33(4)65-57(81)48(32(2)3)71-51(75)34(5)64-54(78)45(27-37-29-62-41-22-15-14-20-39(37)41)70-53(77)43(23-24-47(59)72)67-52(76)40(58)25-35-16-10-8-11-17-35/h8-20,22,29-34,40,42-46,48,62H,6-7,21,23-28,58H2,1-5H3,(H2,59,72)(H2,60,73)(H,61,63)(H,64,78)(H,65,81)(H,66,79)(H,67,76)(H,68,74)(H,69,80)(H,70,77)(H,71,75)/t33-,34-,40+,42-,43-,44-,45-,46-,48-/m0/s1
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0.260n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
NMB


(RAT)
BDBM85488
PNG
(DPhe6,BetaAla11,Phe13,Nle14-Bn(6-14))
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)Cc1ccccc1)C(C)C)C(N)=O
Show InChI InChI=1S/C57H76N14O10/c1-6-7-21-42(49(60)73)66-55(79)44(26-36-18-12-9-13-19-36)69-56(80)46(28-38-30-61-31-63-38)68-50(74)33(4)65-57(81)48(32(2)3)71-51(75)34(5)64-54(78)45(27-37-29-62-41-22-15-14-20-39(37)41)70-53(77)43(23-24-47(59)72)67-52(76)40(58)25-35-16-10-8-11-17-35/h8-20,22,29-34,40,42-46,48,62H,6-7,21,23-28,58H2,1-5H3,(H2,59,72)(H2,60,73)(H,61,63)(H,64,78)(H,65,81)(H,66,79)(H,67,76)(H,68,74)(H,69,80)(H,70,77)(H,71,75)/t33-,34-,40+,42-,43-,44-,45-,46-,48-/m0/s1
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0.360n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Bombesin 4


(Frog)
BDBM85488
PNG
(DPhe6,BetaAla11,Phe13,Nle14-Bn(6-14))
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)Cc1ccccc1)C(C)C)C(N)=O
Show InChI InChI=1S/C57H76N14O10/c1-6-7-21-42(49(60)73)66-55(79)44(26-36-18-12-9-13-19-36)69-56(80)46(28-38-30-61-31-63-38)68-50(74)33(4)65-57(81)48(32(2)3)71-51(75)34(5)64-54(78)45(27-37-29-62-41-22-15-14-20-39(37)41)70-53(77)43(23-24-47(59)72)67-52(76)40(58)25-35-16-10-8-11-17-35/h8-20,22,29-34,40,42-46,48,62H,6-7,21,23-28,58H2,1-5H3,(H2,59,72)(H2,60,73)(H,61,63)(H,64,78)(H,65,81)(H,66,79)(H,67,76)(H,68,74)(H,69,80)(H,70,77)(H,71,75)/t33-,34-,40+,42-,43-,44-,45-,46-,48-/m0/s1
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0.410n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Gastrin-Releasing peptide


(Homo sapiens (Human))
BDBM86502
PNG
(CAS_0 | NSC_0 | [D-Tyr6,Beta-Ala11,Phe13,Nle14]Bn(...)
Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CCNC(=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/c1-5-6-15-42(50(60)75)67-55(80)44(26-34-12-8-7-9-13-34)69-56(81)46(28-37-30-61-31-64-37)66-48(74)23-24-62-57(82)49(32(2)3)71-51(76)33(4)65-54(79)45(27-36-29-63-41-16-11-10-14-39(36)41)70-53(78)43(21-22-47(59)73)68-52(77)40(58)25-35-17-19-38(72)20-18-35/h7-14,16-20,29-33,40,42-46,49,63,72H,5-6,15,21-28,58H2,1-4H3,(H2,59,73)(H2,60,75)(H,61,64)(H,62,82)(H,65,79)(H,66,74)(H,67,80)(H,68,77)(H,69,81)(H,70,78)(H,71,76)/t33-,40+,42-,43-,44-,45-,46-,49-/m0/s1
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0.5n/an/an/an/an/an/an/an/a



National Institutes of Health

Curated by PDSP Ki Database




J Pharmacol Exp Ther 310: 1161-70 (2004)


Article DOI: 10.1124/jpet.104.066761
BindingDB Entry DOI: 10.7270/Q2513WSQ
More data for this
Ligand-Target Pair
Gastrin-Releasing peptide


(RAT)
BDBM85480
PNG
((3-Ph-Pr6)His7,DAla11,DPro13,Psi13-14,Phe14-Bn(6-1...)
Show SMILES CC(C)[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)CCc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1CN[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C57H76N14O9/c1-33(2)49(56(79)66-34(3)51(74)69-47(28-39-30-61-32-64-39)57(80)71-25-13-18-40(71)31-63-45(50(60)73)26-37-16-9-6-10-17-37)70-52(75)35(4)65-55(78)46(27-38-29-62-43-20-12-11-19-41(38)43)68-54(77)44(23-24-48(59)72)67-53(76)42(58)22-21-36-14-7-5-8-15-36/h5-12,14-17,19-20,29-30,32-35,40,42,44-47,49,62-63H,13,18,21-28,31,58H2,1-4H3,(H2,59,72)(H2,60,73)(H,61,64)(H,65,78)(H,66,79)(H,67,76)(H,68,77)(H,69,74)(H,70,75)/t34-,35-,40-,42+,44-,45-,46-,47-,49-/m0/s1
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0.740n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
BRS3


(Homo sapiens (Human))
BDBM86502
PNG
(CAS_0 | NSC_0 | [D-Tyr6,Beta-Ala11,Phe13,Nle14]Bn(...)
Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CCNC(=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/c1-5-6-15-42(50(60)75)67-55(80)44(26-34-12-8-7-9-13-34)69-56(81)46(28-37-30-61-31-64-37)66-48(74)23-24-62-57(82)49(32(2)3)71-51(76)33(4)65-54(79)45(27-36-29-63-41-16-11-10-14-39(36)41)70-53(78)43(21-22-47(59)73)68-52(77)40(58)25-35-17-19-38(72)20-18-35/h7-14,16-20,29-33,40,42-46,49,63,72H,5-6,15,21-28,58H2,1-4H3,(H2,59,73)(H2,60,75)(H,61,64)(H,62,82)(H,65,79)(H,66,74)(H,67,80)(H,68,77)(H,69,81)(H,70,78)(H,71,76)/t33-,40+,42-,43-,44-,45-,46-,49-/m0/s1
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0.820n/an/an/an/an/an/an/an/a



National Institutes of Health

Curated by PDSP Ki Database




J Pharmacol Exp Ther 310: 1161-70 (2004)


Article DOI: 10.1124/jpet.104.066761
BindingDB Entry DOI: 10.7270/Q2513WSQ
More data for this
Ligand-Target Pair
Gastrin-Releasing peptide


(RAT)
BDBM85488
PNG
(DPhe6,BetaAla11,Phe13,Nle14-Bn(6-14))
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)Cc1ccccc1)C(C)C)C(N)=O
Show InChI InChI=1S/C57H76N14O10/c1-6-7-21-42(49(60)73)66-55(79)44(26-36-18-12-9-13-19-36)69-56(80)46(28-38-30-61-31-63-38)68-50(74)33(4)65-57(81)48(32(2)3)71-51(75)34(5)64-54(78)45(27-37-29-62-41-22-15-14-20-39(37)41)70-53(77)43(23-24-47(59)72)67-52(76)40(58)25-35-16-10-8-11-17-35/h8-20,22,29-34,40,42-46,48,62H,6-7,21,23-28,58H2,1-5H3,(H2,59,72)(H2,60,73)(H,61,63)(H,64,78)(H,65,81)(H,66,79)(H,67,76)(H,68,74)(H,69,80)(H,70,77)(H,71,75)/t33-,34-,40+,42-,43-,44-,45-,46-,48-/m0/s1
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0.990n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM135616
PNG
(US10179804, Example 1 | US8846601, 1 | US8846601, ...)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O
Show InChI InChI=1S/C50H70N18O9/c1-28(69)62-35(16-9-19-58-49(52)53)43(72)68-40-24-41(70)57-18-8-7-15-34(42(51)71)63-46(75)38(22-30-25-60-33-14-6-5-13-32(30)33)66-44(73)36(17-10-20-59-50(54)55)64-45(74)37(21-29-11-3-2-4-12-29)65-47(76)39(67-48(40)77)23-31-26-56-27-61-31/h2-6,11-14,25-27,34-40,60H,7-10,15-24H2,1H3,(H2,51,71)(H,56,61)(H,57,70)(H,62,69)(H,63,75)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,72)(H4,52,53,58)(H4,54,55,59)/t34-,35-,36-,37+,38-,39-,40-/m0/s1
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US Patent
5n/an/an/an/an/an/an/an/a



Palatin Technologies, Inc.

US Patent


Assay Description
Accumulation of intracellular cAMP was examined as a measure of the ability of the peptides of the present invention to elicit a functional response ...


US Patent US10179804 (2019)

More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM135616
PNG
(US10179804, Example 1 | US8846601, 1 | US8846601, ...)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O
Show InChI InChI=1S/C50H70N18O9/c1-28(69)62-35(16-9-19-58-49(52)53)43(72)68-40-24-41(70)57-18-8-7-15-34(42(51)71)63-46(75)38(22-30-25-60-33-14-6-5-13-32(30)33)66-44(73)36(17-10-20-59-50(54)55)64-45(74)37(21-29-11-3-2-4-12-29)65-47(76)39(67-48(40)77)23-31-26-56-27-61-31/h2-6,11-14,25-27,34-40,60H,7-10,15-24H2,1H3,(H2,51,71)(H,56,61)(H,57,70)(H,62,69)(H,63,75)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,72)(H4,52,53,58)(H4,54,55,59)/t34-,35-,36-,37+,38-,39-,40-/m0/s1
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5 -11.8n/an/an/an/an/a7.537



Palatin Technologies, Inc.

US Patent


Assay Description
A competitive inhibition binding assay is performed using membrane homogenates prepared from HEK-293 cells that express recombinant hMC4-R, hMC3-R, o...


US Patent US9458201 (2016)


BindingDB Entry DOI: 10.7270/Q2HT2N79
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM135616
PNG
(US10179804, Example 1 | US8846601, 1 | US8846601, ...)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O
Show InChI InChI=1S/C50H70N18O9/c1-28(69)62-35(16-9-19-58-49(52)53)43(72)68-40-24-41(70)57-18-8-7-15-34(42(51)71)63-46(75)38(22-30-25-60-33-14-6-5-13-32(30)33)66-44(73)36(17-10-20-59-50(54)55)64-45(74)37(21-29-11-3-2-4-12-29)65-47(76)39(67-48(40)77)23-31-26-56-27-61-31/h2-6,11-14,25-27,34-40,60H,7-10,15-24H2,1H3,(H2,51,71)(H,56,61)(H,57,70)(H,62,69)(H,63,75)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,72)(H4,52,53,58)(H4,54,55,59)/t34-,35-,36-,37+,38-,39-,40-/m0/s1
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5n/an/an/an/an/an/a7.5n/a



Palatin Technologies, Inc.

US Patent


Assay Description
A competitive inhibition binding assay is performed using membrane homogenates prepared from HEK-293 cells that express recombinant hMC4-R, hMC3-R, o...


US Patent US8846601 (2014)


BindingDB Entry DOI: 10.7270/Q2SF2TWK
More data for this
Ligand-Target Pair
Neuromedin B


(Homo sapiens (Human))
BDBM86502
PNG
(CAS_0 | NSC_0 | [D-Tyr6,Beta-Ala11,Phe13,Nle14]Bn(...)
Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CCNC(=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/c1-5-6-15-42(50(60)75)67-55(80)44(26-34-12-8-7-9-13-34)69-56(81)46(28-37-30-61-31-64-37)66-48(74)23-24-62-57(82)49(32(2)3)71-51(76)33(4)65-54(79)45(27-36-29-63-41-16-11-10-14-39(36)41)70-53(78)43(21-22-47(59)73)68-52(77)40(58)25-35-17-19-38(72)20-18-35/h7-14,16-20,29-33,40,42-46,49,63,72H,5-6,15,21-28,58H2,1-4H3,(H2,59,73)(H2,60,75)(H,61,64)(H,62,82)(H,65,79)(H,66,74)(H,67,80)(H,68,77)(H,69,81)(H,70,78)(H,71,76)/t33-,40+,42-,43-,44-,45-,46-,49-/m0/s1
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5.90n/an/an/an/an/an/an/an/a



National Institutes of Health

Curated by PDSP Ki Database




J Pharmacol Exp Ther 310: 1161-70 (2004)


Article DOI: 10.1124/jpet.104.066761
BindingDB Entry DOI: 10.7270/Q2513WSQ
More data for this
Ligand-Target Pair
Oxytocin receptor


(RAT)
BDBM81890
PNG
(CAS_196819 | L-366,682 | NSC_196819)
Show SMILES CC(C=C)C(NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C1CCCN1C(=O)C(N)Cc1cnc[nH]1)C(=O)N1CCCCC1(C=O)C(=O)N1CCCCC1
Show InChI InChI=1S/C40H53N9O6/c1-3-26(2)34(38(54)49-19-10-7-15-40(49,24-50)39(55)47-16-8-4-9-17-47)46-35(51)32(20-27-22-43-31-13-6-5-12-29(27)31)45-36(52)33-14-11-18-48(33)37(53)30(41)21-28-23-42-25-44-28/h3,5-6,12-13,22-26,30,32-34,43H,1,4,7-11,14-21,41H2,2H3,(H,42,44)(H,45,52)(H,46,51)
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6n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by PDSP Ki Database




J Pharmacol Exp Ther 256: 304-8 (1991)


BindingDB Entry DOI: 10.7270/Q2028Q1G
More data for this
Ligand-Target Pair
Gastrin-Releasing peptide


(RAT)
BDBM85495
PNG
(DPhe6-Bn(6-13)propylamide)
Show SMILES CCCNC(=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](N)Cc1ccccc1)C(C)C
Show InChI InChI=1S/C50H71N13O9/c1-7-19-54-46(68)38(20-28(2)3)61-49(71)40(23-33-25-53-27-57-33)59-42(65)26-56-50(72)43(29(4)5)63-44(66)30(6)58-48(70)39(22-32-24-55-36-16-12-11-15-34(32)36)62-47(69)37(17-18-41(52)64)60-45(67)35(51)21-31-13-9-8-10-14-31/h8-16,24-25,27-30,35,37-40,43,55H,7,17-23,26,51H2,1-6H3,(H2,52,64)(H,53,57)(H,54,68)(H,56,72)(H,58,70)(H,59,65)(H,60,67)(H,61,71)(H,62,69)(H,63,66)/t30-,35+,37-,38-,39-,40-,43-/m0/s1
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6n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Gastrin-Releasing peptide


(RAT)
BDBM85493
PNG
(DTyr6,DAla11-Bn(6-13)butylamide)
Show SMILES CCCCNC(=O)[C@H](CC(C)C)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
Show InChI InChI=1S/C52H75N13O10/c1-8-9-20-56-48(71)40(21-28(2)3)63-51(74)42(24-34-26-55-27-58-34)62-45(68)30(6)60-52(75)44(29(4)5)65-46(69)31(7)59-50(73)41(23-33-25-57-38-13-11-10-12-36(33)38)64-49(72)39(18-19-43(54)67)61-47(70)37(53)22-32-14-16-35(66)17-15-32/h10-17,25-31,37,39-42,44,57,66H,8-9,18-24,53H2,1-7H3,(H2,54,67)(H,55,58)(H,56,71)(H,59,73)(H,60,75)(H,61,70)(H,62,68)(H,63,74)(H,64,72)(H,65,69)/t30-,31+,37-,39+,40+,41+,42+,44+/m1/s1
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6n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
BRS3


(Homo sapiens (Human))
BDBM85488
PNG
(DPhe6,BetaAla11,Phe13,Nle14-Bn(6-14))
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)Cc1ccccc1)C(C)C)C(N)=O
Show InChI InChI=1S/C57H76N14O10/c1-6-7-21-42(49(60)73)66-55(79)44(26-36-18-12-9-13-19-36)69-56(80)46(28-38-30-61-31-63-38)68-50(74)33(4)65-57(81)48(32(2)3)71-51(75)34(5)64-54(78)45(27-37-29-62-41-22-15-14-20-39(37)41)70-53(77)43(23-24-47(59)72)67-52(76)40(58)25-35-16-10-8-11-17-35/h8-20,22,29-34,40,42-46,48,62H,6-7,21,23-28,58H2,1-5H3,(H2,59,72)(H2,60,73)(H,61,63)(H,64,78)(H,65,81)(H,66,79)(H,67,76)(H,68,74)(H,69,80)(H,70,77)(H,71,75)/t33-,34-,40+,42-,43-,44-,45-,46-,48-/m0/s1
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8.90n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Oxytocin receptor


(HEK293)
BDBM81890
PNG
(CAS_196819 | L-366,682 | NSC_196819)
Show SMILES CC(C=C)C(NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C1CCCN1C(=O)C(N)Cc1cnc[nH]1)C(=O)N1CCCCC1(C=O)C(=O)N1CCCCC1
Show InChI InChI=1S/C40H53N9O6/c1-3-26(2)34(38(54)49-19-10-7-15-40(49,24-50)39(55)47-16-8-4-9-17-47)46-35(51)32(20-27-22-43-31-13-6-5-12-29(27)31)45-36(52)33-14-11-18-48(33)37(53)30(41)21-28-23-42-25-44-28/h3,5-6,12-13,22-26,30,32-34,43H,1,4,7-11,14-21,41H2,2H3,(H,42,44)(H,45,52)(H,46,51)
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9.40n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by PDSP Ki Database




J Pharmacol Exp Ther 256: 304-8 (1991)


BindingDB Entry DOI: 10.7270/Q2028Q1G
More data for this
Ligand-Target Pair
Oxytocin receptor


(RAT)
BDBM81890
PNG
(CAS_196819 | L-366,682 | NSC_196819)
Show SMILES CC(C=C)C(NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C1CCCN1C(=O)C(N)Cc1cnc[nH]1)C(=O)N1CCCCC1(C=O)C(=O)N1CCCCC1
Show InChI InChI=1S/C40H53N9O6/c1-3-26(2)34(38(54)49-19-10-7-15-40(49,24-50)39(55)47-16-8-4-9-17-47)46-35(51)32(20-27-22-43-31-13-6-5-12-29(27)31)45-36(52)33-14-11-18-48(33)37(53)30(41)21-28-23-42-25-44-28/h3,5-6,12-13,22-26,30,32-34,43H,1,4,7-11,14-21,41H2,2H3,(H,42,44)(H,45,52)(H,46,51)
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10n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by PDSP Ki Database




J Pharmacol Exp Ther 256: 304-8 (1991)


BindingDB Entry DOI: 10.7270/Q2028Q1G
More data for this
Ligand-Target Pair
OXTR


(Rhesus)
BDBM81890
PNG
(CAS_196819 | L-366,682 | NSC_196819)
Show SMILES CC(C=C)C(NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C1CCCN1C(=O)C(N)Cc1cnc[nH]1)C(=O)N1CCCCC1(C=O)C(=O)N1CCCCC1
Show InChI InChI=1S/C40H53N9O6/c1-3-26(2)34(38(54)49-19-10-7-15-40(49,24-50)39(55)47-16-8-4-9-17-47)46-35(51)32(20-27-22-43-31-13-6-5-12-29(27)31)45-36(52)33-14-11-18-48(33)37(53)30(41)21-28-23-42-25-44-28/h3,5-6,12-13,22-26,30,32-34,43H,1,4,7-11,14-21,41H2,2H3,(H,42,44)(H,45,52)(H,46,51)
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17n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by PDSP Ki Database




J Pharmacol Exp Ther 256: 304-8 (1991)


BindingDB Entry DOI: 10.7270/Q2028Q1G
More data for this
Ligand-Target Pair
Bombesin 4


(Frog)
BDBM85482
PNG
(DPhe6-Bn(6-13)hexylamide)
Show SMILES CCCCCCNC(=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](N)Cc1ccccc1)C(C)C
Show InChI InChI=1S/C53H77N13O9/c1-7-8-9-15-22-57-49(71)41(23-31(2)3)64-52(74)43(26-36-28-56-30-60-36)62-45(68)29-59-53(75)46(32(4)5)66-47(69)33(6)61-51(73)42(25-35-27-58-39-19-14-13-18-37(35)39)65-50(72)40(20-21-44(55)67)63-48(70)38(54)24-34-16-11-10-12-17-34/h10-14,16-19,27-28,30-33,38,40-43,46,58H,7-9,15,20-26,29,54H2,1-6H3,(H2,55,67)(H,56,60)(H,57,71)(H,59,75)(H,61,73)(H,62,68)(H,63,70)(H,64,74)(H,65,72)(H,66,69)/t33-,38+,40-,41-,42-,43-,46-/m0/s1
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18n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM135616
PNG
(US10179804, Example 1 | US8846601, 1 | US8846601, ...)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O
Show InChI InChI=1S/C50H70N18O9/c1-28(69)62-35(16-9-19-58-49(52)53)43(72)68-40-24-41(70)57-18-8-7-15-34(42(51)71)63-46(75)38(22-30-25-60-33-14-6-5-13-32(30)33)66-44(73)36(17-10-20-59-50(54)55)64-45(74)37(21-29-11-3-2-4-12-29)65-47(76)39(67-48(40)77)23-31-26-56-27-61-31/h2-6,11-14,25-27,34-40,60H,7-10,15-24H2,1H3,(H2,51,71)(H,56,61)(H,57,70)(H,62,69)(H,63,75)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,72)(H4,52,53,58)(H4,54,55,59)/t34-,35-,36-,37+,38-,39-,40-/m0/s1
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22n/an/an/an/an/an/a7.5n/a



Palatin Technologies, Inc.

US Patent


Assay Description
A competitive inhibition binding assay is performed using membrane homogenates prepared from HEK-293 cells that express recombinant hMC4-R, hMC3-R, o...


US Patent US8846601 (2014)


BindingDB Entry DOI: 10.7270/Q2SF2TWK
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM135616
PNG
(US10179804, Example 1 | US8846601, 1 | US8846601, ...)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O
Show InChI InChI=1S/C50H70N18O9/c1-28(69)62-35(16-9-19-58-49(52)53)43(72)68-40-24-41(70)57-18-8-7-15-34(42(51)71)63-46(75)38(22-30-25-60-33-14-6-5-13-32(30)33)66-44(73)36(17-10-20-59-50(54)55)64-45(74)37(21-29-11-3-2-4-12-29)65-47(76)39(67-48(40)77)23-31-26-56-27-61-31/h2-6,11-14,25-27,34-40,60H,7-10,15-24H2,1H3,(H2,51,71)(H,56,61)(H,57,70)(H,62,69)(H,63,75)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,72)(H4,52,53,58)(H4,54,55,59)/t34-,35-,36-,37+,38-,39-,40-/m0/s1
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22 -10.9n/an/an/an/an/an/a37



Palatin Technologies, Inc.

US Patent


Assay Description
A competitive inhibition binding assay was performed employing Eu-NDP-α-MSH (PerkinElmer Life Sciences catalog No. AD0225) with determination b...


US Patent US9458201 (2016)


BindingDB Entry DOI: 10.7270/Q2HT2N79
More data for this
Ligand-Target Pair
Gastrin-Releasing peptide


(RAT)
BDBM85494
PNG
(DPhe6-Bn(6-13)NH2)
Show SMILES CC(C)C[C@H](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](N)Cc1ccccc1)C(C)C)C(N)=O
Show InChI InChI=1S/C47H65N13O9/c1-25(2)17-35(41(50)63)58-46(68)37(20-30-22-51-24-54-30)56-39(62)23-53-47(69)40(26(3)4)60-42(64)27(5)55-45(67)36(19-29-21-52-33-14-10-9-13-31(29)33)59-44(66)34(15-16-38(49)61)57-43(65)32(48)18-28-11-7-6-8-12-28/h6-14,21-22,24-27,32,34-37,40,52H,15-20,23,48H2,1-5H3,(H2,49,61)(H2,50,63)(H,51,54)(H,53,69)(H,55,67)(H,56,62)(H,57,65)(H,58,68)(H,59,66)(H,60,64)/t27-,32+,34-,35-,36-,37-,40-/m0/s1
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27n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Gastrin-Releasing peptide


(RAT)
BDBM85490
PNG
(DPhe6,Leu13,Psi(CH2NH),Cpa14-Bn(6-14))
Show SMILES CC(C)C[C@@H](CN[C@@H](C#N)C(N)=O)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](N)Cc1ccccc1)C(C)C
Show InChI InChI=1S/C50H69N15O9/c1-27(2)17-33(24-57-40(21-51)44(54)68)61-49(73)39(20-32-23-55-26-59-32)62-42(67)25-58-50(74)43(28(3)4)65-45(69)29(5)60-48(72)38(19-31-22-56-36-14-10-9-13-34(31)36)64-47(71)37(15-16-41(53)66)63-46(70)35(52)18-30-11-7-6-8-12-30/h6-14,22-23,26-29,33,35,37-40,43,56-57H,15-20,24-25,52H2,1-5H3,(H2,53,66)(H2,54,68)(H,55,59)(H,58,74)(H,60,72)(H,61,73)(H,62,67)(H,63,70)(H,64,71)(H,65,69)/t29-,33-,35+,37-,38-,39-,40-,43-/m0/s1
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42n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Bombesin 4


(Frog)
BDBM85495
PNG
(DPhe6-Bn(6-13)propylamide)
Show SMILES CCCNC(=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](N)Cc1ccccc1)C(C)C
Show InChI InChI=1S/C50H71N13O9/c1-7-19-54-46(68)38(20-28(2)3)61-49(71)40(23-33-25-53-27-57-33)59-42(65)26-56-50(72)43(29(4)5)63-44(66)30(6)58-48(70)39(22-32-24-55-36-16-12-11-15-34(32)36)62-47(69)37(17-18-41(52)64)60-45(67)35(51)21-31-13-9-8-10-14-31/h8-16,24-25,27-30,35,37-40,43,55H,7,17-23,26,51H2,1-6H3,(H2,52,64)(H,53,57)(H,54,68)(H,56,72)(H,58,70)(H,59,65)(H,60,67)(H,61,71)(H,62,69)(H,63,66)/t30-,35+,37-,38-,39-,40-,43-/m0/s1
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62n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Bombesin 4


(Frog)
BDBM85480
PNG
((3-Ph-Pr6)His7,DAla11,DPro13,Psi13-14,Phe14-Bn(6-1...)
Show SMILES CC(C)[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)CCc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1CN[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C57H76N14O9/c1-33(2)49(56(79)66-34(3)51(74)69-47(28-39-30-61-32-64-39)57(80)71-25-13-18-40(71)31-63-45(50(60)73)26-37-16-9-6-10-17-37)70-52(75)35(4)65-55(78)46(27-38-29-62-43-20-12-11-19-41(38)43)68-54(77)44(23-24-48(59)72)67-53(76)42(58)22-21-36-14-7-5-8-15-36/h5-12,14-17,19-20,29-30,32-35,40,42,44-47,49,62-63H,13,18,21-28,31,58H2,1-4H3,(H2,59,72)(H2,60,73)(H,61,64)(H,65,78)(H,66,79)(H,67,76)(H,68,77)(H,69,74)(H,70,75)/t34-,35-,40-,42+,44-,45-,46-,47-,49-/m0/s1
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67n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Gastrin-Releasing peptide


(Homo sapiens (Human))
BDBM86500
PNG
(CAS_0 | NSC_0 | [D-Tyr6,Beta-Ala11,Phe13,Beta-Dap(...)
Show SMILES CC(C)[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(=O)NCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)C(N)=O
Show InChI InChI=1S/C54H71N15O11/c1-29(2)46(54(80)60-20-19-45(72)65-43(24-34-26-59-28-63-34)53(79)67-41(22-31-9-5-4-6-10-31)50(76)62-27-38(56)47(58)73)69-48(74)30(3)64-52(78)42(23-33-25-61-39-12-8-7-11-36(33)39)68-51(77)40(17-18-44(57)71)66-49(75)37(55)21-32-13-15-35(70)16-14-32/h4-16,25-26,28-30,37-38,40-43,46,61,70H,17-24,27,55-56H2,1-3H3,(H2,57,71)(H2,58,73)(H,59,63)(H,60,80)(H,62,76)(H,64,78)(H,65,72)(H,66,75)(H,67,79)(H,68,77)(H,69,74)/t30-,37+,38?,40-,41-,42-,43-,46-/m0/s1
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85n/an/an/an/an/an/an/an/a



National Institutes of Health

Curated by PDSP Ki Database




J Pharmacol Exp Ther 310: 1161-70 (2004)


Article DOI: 10.1124/jpet.104.066761
BindingDB Entry DOI: 10.7270/Q2513WSQ
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM135616
PNG
(US10179804, Example 1 | US8846601, 1 | US8846601, ...)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O
Show InChI InChI=1S/C50H70N18O9/c1-28(69)62-35(16-9-19-58-49(52)53)43(72)68-40-24-41(70)57-18-8-7-15-34(42(51)71)63-46(75)38(22-30-25-60-33-14-6-5-13-32(30)33)66-44(73)36(17-10-20-59-50(54)55)64-45(74)37(21-29-11-3-2-4-12-29)65-47(76)39(67-48(40)77)23-31-26-56-27-61-31/h2-6,11-14,25-27,34-40,60H,7-10,15-24H2,1H3,(H2,51,71)(H,56,61)(H,57,70)(H,62,69)(H,63,75)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,72)(H4,52,53,58)(H4,54,55,59)/t34-,35-,36-,37+,38-,39-,40-/m0/s1
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87n/an/an/an/an/an/a7.5n/a



Palatin Technologies, Inc.

US Patent


Assay Description
A competitive inhibition binding assay is performed using membrane homogenates prepared from HEK-293 cells that express recombinant hMC4-R, hMC3-R, o...


US Patent US8846601 (2014)


BindingDB Entry DOI: 10.7270/Q2SF2TWK
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM135616
PNG
(US10179804, Example 1 | US8846601, 1 | US8846601, ...)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O
Show InChI InChI=1S/C50H70N18O9/c1-28(69)62-35(16-9-19-58-49(52)53)43(72)68-40-24-41(70)57-18-8-7-15-34(42(51)71)63-46(75)38(22-30-25-60-33-14-6-5-13-32(30)33)66-44(73)36(17-10-20-59-50(54)55)64-45(74)37(21-29-11-3-2-4-12-29)65-47(76)39(67-48(40)77)23-31-26-56-27-61-31/h2-6,11-14,25-27,34-40,60H,7-10,15-24H2,1H3,(H2,51,71)(H,56,61)(H,57,70)(H,62,69)(H,63,75)(H,64,74)(H,65,76)(H,66,73)(H,67,77)(H,68,72)(H4,52,53,58)(H4,54,55,59)/t34-,35-,36-,37+,38-,39-,40-/m0/s1
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87 -10.0n/an/an/an/an/a7.537



Palatin Technologies, Inc.

US Patent


Assay Description
A competitive inhibition binding assay is performed using membrane homogenates prepared from HEK-293 cells that express recombinant hMC4-R, hMC3-R, o...


US Patent US9458201 (2016)


BindingDB Entry DOI: 10.7270/Q2HT2N79
More data for this
Ligand-Target Pair
Bombesin 4


(Frog)
BDBM85493
PNG
(DTyr6,DAla11-Bn(6-13)butylamide)
Show SMILES CCCCNC(=O)[C@H](CC(C)C)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
Show InChI InChI=1S/C52H75N13O10/c1-8-9-20-56-48(71)40(21-28(2)3)63-51(74)42(24-34-26-55-27-58-34)62-45(68)30(6)60-52(75)44(29(4)5)65-46(69)31(7)59-50(73)41(23-33-25-57-38-13-11-10-12-36(33)38)64-49(72)39(18-19-43(54)67)61-47(70)37(53)22-32-14-16-35(66)17-15-32/h10-17,25-31,37,39-42,44,57,66H,8-9,18-24,53H2,1-7H3,(H2,54,67)(H,55,58)(H,56,71)(H,59,73)(H,60,75)(H,61,70)(H,62,68)(H,63,74)(H,64,72)(H,65,69)/t30-,31+,37-,39+,40+,41+,42+,44+/m1/s1
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98n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Gastrin-Releasing peptide


(RAT)
BDBM85482
PNG
(DPhe6-Bn(6-13)hexylamide)
Show SMILES CCCCCCNC(=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](N)Cc1ccccc1)C(C)C
Show InChI InChI=1S/C53H77N13O9/c1-7-8-9-15-22-57-49(71)41(23-31(2)3)64-52(74)43(26-36-28-56-30-60-36)62-45(68)29-59-53(75)46(32(4)5)66-47(69)33(6)61-51(73)42(25-35-27-58-39-19-14-13-18-37(35)39)65-50(72)40(20-21-44(55)67)63-48(70)38(54)24-34-16-11-10-12-17-34/h10-14,16-19,27-28,30-33,38,40-43,46,58H,7-9,15,20-26,29,54H2,1-6H3,(H2,55,67)(H,56,60)(H,57,71)(H,59,75)(H,61,73)(H,62,68)(H,63,70)(H,64,74)(H,65,72)(H,66,69)/t33-,38+,40-,41-,42-,43-,46-/m0/s1
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100n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (Human))
BDBM86303
PNG
(WKHMVm-NH2)
Show SMILES CSCC[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](CCCCN)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(C)C)C(N)=O
Show InChI InChI=1S/C38H59N11O6S2/c1-22(2)32(38(55)45-28(33(41)50)12-15-56-3)49-36(53)30(13-16-57-4)47-37(54)31(18-24-20-42-21-44-24)48-35(52)29(11-7-8-14-39)46-34(51)26(40)17-23-19-43-27-10-6-5-9-25(23)27/h5-6,9-10,19-22,26,28-32,43H,7-8,11-18,39-40H2,1-4H3,(H2,41,50)(H,42,44)(H,45,55)(H,46,51)(H,47,54)(H,48,52)(H,49,53)/t26-,28+,29+,30-,31-,32-/m0/s1
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282n/an/an/an/an/an/an/an/a



Pohang University of Science and Technology

Curated by PDSP Ki Database




Mol Pharmacol 64: 841-7 (2003)


Article DOI: 10.1124/mol.64.4.841
BindingDB Entry DOI: 10.7270/Q2WQ02D4
More data for this
Ligand-Target Pair
Gastrin-Releasing peptide


(RAT)
BDBM85479
PNG
(DPhe6-Bn(1-13)NH2)
Show SMILES CC(C)C[C@H](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](Cc1ccccc1)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
Show InChI InChI=1S/C71H104N22O16/c1-36(2)26-49(60(74)99)90-69(108)53(30-42-32-77-35-82-42)86-58(98)34-81-70(109)59(38(5)6)93-61(100)39(7)83-67(106)52(29-41-31-79-44-17-12-11-16-43(41)44)92-66(105)48(20-23-55(73)95)89-68(107)51(28-40-14-9-8-10-15-40)85-57(97)33-80-62(101)50(27-37(3)4)91-63(102)45(18-13-25-78-71(75)76)87-65(104)47(19-22-54(72)94)88-64(103)46-21-24-56(96)84-46/h8-12,14-17,31-32,35-39,45-53,59,79H,13,18-30,33-34H2,1-7H3,(H2,72,94)(H2,73,95)(H2,74,99)(H,77,82)(H,80,101)(H,81,109)(H,83,106)(H,84,96)(H,85,97)(H,86,98)(H,87,104)(H,88,103)(H,89,107)(H,90,108)(H,91,102)(H,92,105)(H,93,100)(H4,75,76,78)/t39-,45-,46-,47-,48-,49-,50-,51+,52-,53-,59-/m0/s1
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450n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM135621
PNG
(US10179804, Example 6 | US8846601, 6 | US9458201, ...)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O
Show InChI InChI=1S/C50H70N16O9/c1-29(67)60-36(18-11-21-57-50(53)54)44(70)66-41-25-42(68)56-20-10-8-16-35(43(52)69)61-47(73)39(23-31-26-58-34-15-6-5-14-33(31)34)64-45(71)37(17-7-9-19-51)62-46(72)38(22-30-12-3-2-4-13-30)63-48(74)40(65-49(41)75)24-32-27-55-28-59-32/h2-6,12-15,26-28,35-41,58H,7-11,16-25,51H2,1H3,(H2,52,69)(H,55,59)(H,56,68)(H,60,67)(H,61,73)(H,62,72)(H,63,74)(H,64,71)(H,65,75)(H,66,70)(H4,53,54,57)/t35-,36-,37-,38+,39-,40-,41-/m0/s1
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533n/an/an/an/an/an/a7.5n/a



Palatin Technologies, Inc.

US Patent


Assay Description
A competitive inhibition binding assay is performed using membrane homogenates prepared from HEK-293 cells that express recombinant hMC4-R, hMC3-R, o...


US Patent US8846601 (2014)


BindingDB Entry DOI: 10.7270/Q2SF2TWK
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM135621
PNG
(US10179804, Example 6 | US8846601, 6 | US9458201, ...)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O
Show InChI InChI=1S/C50H70N16O9/c1-29(67)60-36(18-11-21-57-50(53)54)44(70)66-41-25-42(68)56-20-10-8-16-35(43(52)69)61-47(73)39(23-31-26-58-34-15-6-5-14-33(31)34)64-45(71)37(17-7-9-19-51)62-46(72)38(22-30-12-3-2-4-13-30)63-48(74)40(65-49(41)75)24-32-27-55-28-59-32/h2-6,12-15,26-28,35-41,58H,7-11,16-25,51H2,1H3,(H2,52,69)(H,55,59)(H,56,68)(H,60,67)(H,61,73)(H,62,72)(H,63,74)(H,64,71)(H,65,75)(H,66,70)(H4,53,54,57)/t35-,36-,37-,38+,39-,40-,41-/m0/s1
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533 -8.90n/an/an/an/an/an/a37



Palatin Technologies, Inc.

US Patent


Assay Description
A competitive inhibition binding assay was performed employing Eu-NDP-α-MSH (PerkinElmer Life Sciences catalog No. AD0225) with determination b...


US Patent US9458201 (2016)


BindingDB Entry DOI: 10.7270/Q2HT2N79
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM135621
PNG
(US10179804, Example 6 | US8846601, 6 | US9458201, ...)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O
Show InChI InChI=1S/C50H70N16O9/c1-29(67)60-36(18-11-21-57-50(53)54)44(70)66-41-25-42(68)56-20-10-8-16-35(43(52)69)61-47(73)39(23-31-26-58-34-15-6-5-14-33(31)34)64-45(71)37(17-7-9-19-51)62-46(72)38(22-30-12-3-2-4-13-30)63-48(74)40(65-49(41)75)24-32-27-55-28-59-32/h2-6,12-15,26-28,35-41,58H,7-11,16-25,51H2,1H3,(H2,52,69)(H,55,59)(H,56,68)(H,60,67)(H,61,73)(H,62,72)(H,63,74)(H,64,71)(H,65,75)(H,66,70)(H4,53,54,57)/t35-,36-,37-,38+,39-,40-,41-/m0/s1
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533n/an/an/an/an/an/an/an/a



Palatin Technologies, Inc.

US Patent


Assay Description
Accumulation of intracellular cAMP was examined as a measure of the ability of the peptides of the present invention to elicit a functional response ...


US Patent US10179804 (2019)

More data for this
Ligand-Target Pair
Bombesin 4


(Frog)
BDBM85494
PNG
(DPhe6-Bn(6-13)NH2)
Show SMILES CC(C)C[C@H](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](N)Cc1ccccc1)C(C)C)C(N)=O
Show InChI InChI=1S/C47H65N13O9/c1-25(2)17-35(41(50)63)58-46(68)37(20-30-22-51-24-54-30)56-39(62)23-53-47(69)40(26(3)4)60-42(64)27(5)55-45(67)36(19-29-21-52-33-14-10-9-13-31(29)33)59-44(66)34(15-16-38(49)61)57-43(65)32(48)18-28-11-7-6-8-12-28/h6-14,21-22,24-27,32,34-37,40,52H,15-20,23,48H2,1-5H3,(H2,49,61)(H2,50,63)(H,51,54)(H,53,69)(H,55,67)(H,56,62)(H,57,65)(H,58,68)(H,59,66)(H,60,64)/t27-,32+,34-,35-,36-,37-,40-/m0/s1
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974n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Gastrin-Releasing peptide


(RAT)
BDBM85501
PNG
(DPhe6-Bn(6-13)hydrazide)
Show SMILES CC(C)C[C@H](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](N)Cc1ccccc1)C(C)C)C(=O)NN
Show InChI InChI=1S/C47H66N14O9/c1-25(2)17-35(46(69)61-50)58-45(68)37(20-30-22-51-24-54-30)56-39(63)23-53-47(70)40(26(3)4)60-41(64)27(5)55-44(67)36(19-29-21-52-33-14-10-9-13-31(29)33)59-43(66)34(15-16-38(49)62)57-42(65)32(48)18-28-11-7-6-8-12-28/h6-14,21-22,24-27,32,34-37,40,52H,15-20,23,48,50H2,1-5H3,(H2,49,62)(H,51,54)(H,53,70)(H,55,67)(H,56,63)(H,57,65)(H,58,68)(H,59,66)(H,60,64)(H,61,69)/t27-,32+,34-,35-,36-,37-,40-/m0/s1
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1.20E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Bombesin 4


(Frog)
BDBM85490
PNG
(DPhe6,Leu13,Psi(CH2NH),Cpa14-Bn(6-14))
Show SMILES CC(C)C[C@@H](CN[C@@H](C#N)C(N)=O)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](N)Cc1ccccc1)C(C)C
Show InChI InChI=1S/C50H69N15O9/c1-27(2)17-33(24-57-40(21-51)44(54)68)61-49(73)39(20-32-23-55-26-59-32)62-42(67)25-58-50(74)43(28(3)4)65-45(69)29(5)60-48(72)38(19-31-22-56-36-14-10-9-13-34(31)36)64-47(71)37(15-16-41(53)66)63-46(70)35(52)18-30-11-7-6-8-12-30/h6-14,22-23,26-29,33,35,37-40,43,56-57H,15-20,24-25,52H2,1-5H3,(H2,53,66)(H2,54,68)(H,55,59)(H,58,74)(H,60,72)(H,61,73)(H,62,67)(H,63,70)(H,64,71)(H,65,69)/t29-,33-,35+,37-,38-,39-,40-,43-/m0/s1
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1.29E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Vasopressin V2 Receptor


(Rattus norvegicus (Rat))
BDBM81890
PNG
(CAS_196819 | L-366,682 | NSC_196819)
Show SMILES CC(C=C)C(NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C1CCCN1C(=O)C(N)Cc1cnc[nH]1)C(=O)N1CCCCC1(C=O)C(=O)N1CCCCC1
Show InChI InChI=1S/C40H53N9O6/c1-3-26(2)34(38(54)49-19-10-7-15-40(49,24-50)39(55)47-16-8-4-9-17-47)46-35(51)32(20-27-22-43-31-13-6-5-12-29(27)31)45-36(52)33-14-11-18-48(33)37(53)30(41)21-28-23-42-25-44-28/h3,5-6,12-13,22-26,30,32-34,43H,1,4,7-11,14-21,41H2,2H3,(H,42,44)(H,45,52)(H,46,51)
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1.80E+3n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by PDSP Ki Database




J Pharmacol Exp Ther 256: 304-8 (1991)


BindingDB Entry DOI: 10.7270/Q2028Q1G
More data for this
Ligand-Target Pair
BRS3


(Homo sapiens (Human))
BDBM85495
PNG
(DPhe6-Bn(6-13)propylamide)
Show SMILES CCCNC(=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](N)Cc1ccccc1)C(C)C
Show InChI InChI=1S/C50H71N13O9/c1-7-19-54-46(68)38(20-28(2)3)61-49(71)40(23-33-25-53-27-57-33)59-42(65)26-56-50(72)43(29(4)5)63-44(66)30(6)58-48(70)39(22-32-24-55-36-16-12-11-15-34(32)36)62-47(69)37(17-18-41(52)64)60-45(67)35(51)21-31-13-9-8-10-14-31/h8-16,24-25,27-30,35,37-40,43,55H,7,17-23,26,51H2,1-6H3,(H2,52,64)(H,53,57)(H,54,68)(H,56,72)(H,58,70)(H,59,65)(H,60,67)(H,61,71)(H,62,69)(H,63,66)/t30-,35+,37-,38-,39-,40-,43-/m0/s1
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1.90E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
VASOPRESSIN V1


(RAT)
BDBM81890
PNG
(CAS_196819 | L-366,682 | NSC_196819)
Show SMILES CC(C=C)C(NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C1CCCN1C(=O)C(N)Cc1cnc[nH]1)C(=O)N1CCCCC1(C=O)C(=O)N1CCCCC1
Show InChI InChI=1S/C40H53N9O6/c1-3-26(2)34(38(54)49-19-10-7-15-40(49,24-50)39(55)47-16-8-4-9-17-47)46-35(51)32(20-27-22-43-31-13-6-5-12-29(27)31)45-36(52)33-14-11-18-48(33)37(53)30(41)21-28-23-42-25-44-28/h3,5-6,12-13,22-26,30,32-34,43H,1,4,7-11,14-21,41H2,2H3,(H,42,44)(H,45,52)(H,46,51)
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2.20E+3n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by PDSP Ki Database




J Pharmacol Exp Ther 256: 304-8 (1991)


BindingDB Entry DOI: 10.7270/Q2028Q1G
More data for this
Ligand-Target Pair
Bombesin 4


(Frog)
BDBM85501
PNG
(DPhe6-Bn(6-13)hydrazide)
Show SMILES CC(C)C[C@H](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](N)Cc1ccccc1)C(C)C)C(=O)NN
Show InChI InChI=1S/C47H66N14O9/c1-25(2)17-35(46(69)61-50)58-45(68)37(20-30-22-51-24-54-30)56-39(63)23-53-47(70)40(26(3)4)60-41(64)27(5)55-44(67)36(19-29-21-52-33-14-10-9-13-31(29)33)59-43(66)34(15-16-38(49)62)57-42(65)32(48)18-28-11-7-6-8-12-28/h6-14,21-22,24-27,32,34-37,40,52H,15-20,23,48,50H2,1-5H3,(H2,49,62)(H,51,54)(H,53,70)(H,55,67)(H,56,63)(H,57,65)(H,58,68)(H,59,66)(H,60,64)(H,61,69)/t27-,32+,34-,35-,36-,37-,40-/m0/s1
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2.24E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
NMB


(RAT)
BDBM85493
PNG
(DTyr6,DAla11-Bn(6-13)butylamide)
Show SMILES CCCCNC(=O)[C@H](CC(C)C)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
Show InChI InChI=1S/C52H75N13O10/c1-8-9-20-56-48(71)40(21-28(2)3)63-51(74)42(24-34-26-55-27-58-34)62-45(68)30(6)60-52(75)44(29(4)5)65-46(69)31(7)59-50(73)41(23-33-25-57-38-13-11-10-12-36(33)38)64-49(72)39(18-19-43(54)67)61-47(70)37(53)22-32-14-16-35(66)17-15-32/h10-17,25-31,37,39-42,44,57,66H,8-9,18-24,53H2,1-7H3,(H2,54,67)(H,55,58)(H,56,71)(H,59,73)(H,60,75)(H,61,70)(H,62,68)(H,63,74)(H,64,72)(H,65,69)/t30-,31+,37-,39+,40+,41+,42+,44+/m1/s1
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2.30E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
BRS3


(Homo sapiens (Human))
BDBM86500
PNG
(CAS_0 | NSC_0 | [D-Tyr6,Beta-Ala11,Phe13,Beta-Dap(...)
Show SMILES CC(C)[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(=O)NCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)C(N)=O
Show InChI InChI=1S/C54H71N15O11/c1-29(2)46(54(80)60-20-19-45(72)65-43(24-34-26-59-28-63-34)53(79)67-41(22-31-9-5-4-6-10-31)50(76)62-27-38(56)47(58)73)69-48(74)30(3)64-52(78)42(23-33-25-61-39-12-8-7-11-36(33)39)68-51(77)40(17-18-44(57)71)66-49(75)37(55)21-32-13-15-35(70)16-14-32/h4-16,25-26,28-30,37-38,40-43,46,61,70H,17-24,27,55-56H2,1-3H3,(H2,57,71)(H2,58,73)(H,59,63)(H,60,80)(H,62,76)(H,64,78)(H,65,72)(H,66,75)(H,67,79)(H,68,77)(H,69,74)/t30-,37+,38?,40-,41-,42-,43-,46-/m0/s1
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2.40E+3n/an/an/an/an/an/an/an/a



National Institutes of Health

Curated by PDSP Ki Database




J Pharmacol Exp Ther 310: 1161-70 (2004)


Article DOI: 10.1124/jpet.104.066761
BindingDB Entry DOI: 10.7270/Q2513WSQ
More data for this
Ligand-Target Pair
NMB


(RAT)
BDBM85490
PNG
(DPhe6,Leu13,Psi(CH2NH),Cpa14-Bn(6-14))
Show SMILES CC(C)C[C@@H](CN[C@@H](C#N)C(N)=O)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](N)Cc1ccccc1)C(C)C
Show InChI InChI=1S/C50H69N15O9/c1-27(2)17-33(24-57-40(21-51)44(54)68)61-49(73)39(20-32-23-55-26-59-32)62-42(67)25-58-50(74)43(28(3)4)65-45(69)29(5)60-48(72)38(19-31-22-56-36-14-10-9-13-34(31)36)64-47(71)37(15-16-41(53)66)63-46(70)35(52)18-30-11-7-6-8-12-30/h6-14,22-23,26-29,33,35,37-40,43,56-57H,15-20,24-25,52H2,1-5H3,(H2,53,66)(H2,54,68)(H,55,59)(H,58,74)(H,60,72)(H,61,73)(H,62,67)(H,63,70)(H,64,71)(H,65,69)/t29-,33-,35+,37-,38-,39-,40-,43-/m0/s1
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2.70E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Vasopressin V2 Receptor


(Rattus norvegicus (Rat))
BDBM81890
PNG
(CAS_196819 | L-366,682 | NSC_196819)
Show SMILES CC(C=C)C(NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C1CCCN1C(=O)C(N)Cc1cnc[nH]1)C(=O)N1CCCCC1(C=O)C(=O)N1CCCCC1
Show InChI InChI=1S/C40H53N9O6/c1-3-26(2)34(38(54)49-19-10-7-15-40(49,24-50)39(55)47-16-8-4-9-17-47)46-35(51)32(20-27-22-43-31-13-6-5-12-29(27)31)45-36(52)33-14-11-18-48(33)37(53)30(41)21-28-23-42-25-44-28/h3,5-6,12-13,22-26,30,32-34,43H,1,4,7-11,14-21,41H2,2H3,(H,42,44)(H,45,52)(H,46,51)
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3.10E+3n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by PDSP Ki Database




J Pharmacol Exp Ther 256: 304-8 (1991)


BindingDB Entry DOI: 10.7270/Q2028Q1G
More data for this
Ligand-Target Pair
BRS3


(Homo sapiens (Human))
BDBM85482
PNG
(DPhe6-Bn(6-13)hexylamide)
Show SMILES CCCCCCNC(=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](N)Cc1ccccc1)C(C)C
Show InChI InChI=1S/C53H77N13O9/c1-7-8-9-15-22-57-49(71)41(23-31(2)3)64-52(74)43(26-36-28-56-30-60-36)62-45(68)29-59-53(75)46(32(4)5)66-47(69)33(6)61-51(73)42(25-35-27-58-39-19-14-13-18-37(35)39)65-50(72)40(20-21-44(55)67)63-48(70)38(54)24-34-16-11-10-12-17-34/h10-14,16-19,27-28,30-33,38,40-43,46,58H,7-9,15,20-26,29,54H2,1-6H3,(H2,55,67)(H,56,60)(H,57,71)(H,59,75)(H,61,73)(H,62,68)(H,63,70)(H,64,74)(H,65,72)(H,66,69)/t33-,38+,40-,41-,42-,43-,46-/m0/s1
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3.20E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
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