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Compile Data Set for Download or QSAR

Found 137 hits of ic50 data for polymerid = 49000608,49000609,6680   
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
Somatostatin receptor type 2


(MOUSE)
BDBM84616
PNG
(BIM 23069 | CAS_150155-67-2 | L-Alaninamide,4-chlo...)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](N)Cc1ccc(Cl)cc1)C(=O)N[C@@H](C)C(C)=O |r|
Show InChI InChI=1S/C47H62ClN9O8/c1-26(2)41(47(65)52-27(3)29(5)58)57-44(62)38(12-8-9-21-49)54-46(64)40(24-32-25-51-37-11-7-6-10-35(32)37)56-45(63)39(23-31-15-19-34(59)20-16-31)55-42(60)28(4)53-43(61)36(50)22-30-13-17-33(48)18-14-30/h6-7,10-11,13-20,25-28,36,38-41,51,59H,8-9,12,21-24,49-50H2,1-5H3,(H,52,65)(H,53,61)(H,54,64)(H,55,60)(H,56,63)(H,57,62)/t27-,28-,36+,38-,39-,40+,41-/m0/s1
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22n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM82253
PNG
(BIM 23052 | CAS_133073-82-2)
Show SMILES C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](N)Cc1ccccc1)[C@@H](C)O)C(N)=O |r|
Show InChI InChI=1S/C61H75N11O10/c1-37(73)52(54(64)75)71-60(81)50(34-42-25-13-6-14-26-42)70-61(82)53(38(2)74)72-56(77)47(29-17-18-30-62)66-59(80)51(35-43-36-65-46-28-16-15-27-44(43)46)69-58(79)49(33-41-23-11-5-12-24-41)68-57(78)48(32-40-21-9-4-10-22-40)67-55(76)45(63)31-39-19-7-3-8-20-39/h3-16,19-28,36-38,45,47-53,65,73-74H,17-18,29-35,62-63H2,1-2H3,(H2,64,75)(H,66,80)(H,67,76)(H,68,78)(H,69,79)(H,70,82)(H,71,81)(H,72,77)/t37-,38-,45-,47+,48+,49+,50+,51-,52+,53+/m1/s1
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23n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM82466
PNG
(L-362,862 | L-362862 | c[Aha-Phe-p-C1-Phe-D-Trp-Ly...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCCCCNC(=O)[C@H](Cc2ccccc2)NC1=O
Show InChI InChI=1S/C55H68ClN9O8/c1-35(66)49-55(73)64-44(30-36-16-6-4-7-17-36)50(68)58-29-15-3-2-10-23-48(67)60-45(32-38-24-26-40(56)27-25-38)52(70)62-46(31-37-18-8-5-9-19-37)53(71)63-47(33-39-34-59-42-21-12-11-20-41(39)42)54(72)61-43(51(69)65-49)22-13-14-28-57/h4-9,11-12,16-21,24-27,34-35,43-47,49,59,66H,2-3,10,13-15,22-23,28-33,57H2,1H3,(H,58,68)(H,60,67)(H,61,72)(H,62,70)(H,63,71)(H,64,73)(H,65,69)/t35-,43+,44+,45+,46+,47-,49+/m1/s1
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24n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(MOUSE)
BDBM82454
PNG
(L-363,572 | N-Methylcyclo(D-Ala-D-Phe-D-Trp-L-Lys-...)
Show SMILES C[C@H](O)[C@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](C)N(C)C(=O)[C@@H](Cc2ccccc2)N(C)C1=O
Show InChI InChI=1S/C44H56N8O7/c1-27-39(54)48-35(23-29-15-7-5-8-16-29)41(56)49-36(25-31-26-46-33-20-12-11-19-32(31)33)42(57)47-34(21-13-14-22-45)40(55)50-38(28(2)53)44(59)52(4)37(43(58)51(27)3)24-30-17-9-6-10-18-30/h5-12,15-20,26-28,34-38,46,53H,13-14,21-25,45H2,1-4H3,(H,47,57)(H,48,54)(H,49,56)(H,50,55)/t27-,28+,34+,35-,36-,37-,38-/m1/s1
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26n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(MOUSE)
BDBM82463
PNG
(Cyclo[L-Trp-D-Trp-L-Lys-L-Thr-L-Phe-(7-amino*hepta...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)CCCCCCNC(=O)[C@H](Cc2ccccc2)NC1=O
Show InChI InChI=1S/C57H70N10O8/c1-36(68)51-57(75)66-46(30-37-18-6-4-7-19-37)52(70)59-29-17-3-2-10-27-50(69)62-47(31-38-20-8-5-9-21-38)54(72)64-49(33-40-35-61-44-25-14-12-23-42(40)44)56(74)65-48(32-39-34-60-43-24-13-11-22-41(39)43)55(73)63-45(53(71)67-51)26-15-16-28-58/h4-9,11-14,18-25,34-36,45-49,51,60-61,68H,2-3,10,15-17,26-33,58H2,1H3,(H,59,70)(H,62,69)(H,63,73)(H,64,72)(H,65,74)(H,66,75)(H,67,71)/t36-,45+,46+,47+,48-,49+,51+/m1/s1
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29n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM82463
PNG
(Cyclo[L-Trp-D-Trp-L-Lys-L-Thr-L-Phe-(7-amino*hepta...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)CCCCCCNC(=O)[C@H](Cc2ccccc2)NC1=O
Show InChI InChI=1S/C57H70N10O8/c1-36(68)51-57(75)66-46(30-37-18-6-4-7-19-37)52(70)59-29-17-3-2-10-27-50(69)62-47(31-38-20-8-5-9-21-38)54(72)64-49(33-40-35-61-44-25-14-12-23-42(40)44)56(74)65-48(32-39-34-60-43-24-13-11-22-41(39)43)55(73)63-45(53(71)67-51)26-15-16-28-58/h4-9,11-14,18-25,34-36,45-49,51,60-61,68H,2-3,10,15-17,26-33,58H2,1H3,(H,59,70)(H,62,69)(H,63,73)(H,64,72)(H,65,74)(H,66,75)(H,67,71)/t36-,45+,46+,47+,48-,49+,51+/m1/s1
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30n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(MOUSE)
BDBM82253
PNG
(BIM 23052 | CAS_133073-82-2)
Show SMILES C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](N)Cc1ccccc1)[C@@H](C)O)C(N)=O |r|
Show InChI InChI=1S/C61H75N11O10/c1-37(73)52(54(64)75)71-60(81)50(34-42-25-13-6-14-26-42)70-61(82)53(38(2)74)72-56(77)47(29-17-18-30-62)66-59(80)51(35-43-36-65-46-28-16-15-27-44(43)46)69-58(79)49(33-41-23-11-5-12-24-41)68-57(78)48(32-40-21-9-4-10-22-40)67-55(76)45(63)31-39-19-7-3-8-20-39/h3-16,19-28,36-38,45,47-53,65,73-74H,17-18,29-35,62-63H2,1-2H3,(H2,64,75)(H,66,80)(H,67,76)(H,68,78)(H,69,79)(H,70,82)(H,71,81)(H,72,77)/t37-,38-,45-,47+,48+,49+,50+,51-,52+,53+/m1/s1
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32n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM84643
PNG
(BIM 23064)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C(N)=O
Show InChI InChI=1S/C61H74ClN11O9/c1-36(2)53(61(82)72-49(31-39-16-8-5-9-17-39)57(78)67-37(3)54(65)75)73-56(77)48(20-12-13-29-63)68-60(81)52(34-42-35-66-47-19-11-10-18-45(42)47)71-59(80)51(33-41-23-27-44(74)28-24-41)70-58(79)50(32-40-21-25-43(62)26-22-40)69-55(76)46(64)30-38-14-6-4-7-15-38/h4-11,14-19,21-28,35-37,46,48-53,66,74H,12-13,20,29-34,63-64H2,1-3H3,(H2,65,75)(H,67,78)(H,68,81)(H,69,76)(H,70,79)(H,71,80)(H,72,82)(H,73,77)/t37-,46-,48+,49+,50+,51+,52-,53+/m1/s1
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34n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM82468
PNG
(BIM 23055 | D-Phe-Phe-Tyr-D-Trp-Lys-Val-Phe-D-Phe-...)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C67H79N11O9/c1-42(2)59(67(87)77-57(38-46-25-13-6-14-26-46)63(83)73-54(60(70)80)36-44-21-9-4-10-22-44)78-62(82)53(29-17-18-34-68)72-66(86)58(40-48-41-71-52-28-16-15-27-50(48)52)76-65(85)56(39-47-30-32-49(79)33-31-47)75-64(84)55(37-45-23-11-5-12-24-45)74-61(81)51(69)35-43-19-7-3-8-20-43/h3-16,19-28,30-33,41-42,51,53-59,71,79H,17-18,29,34-40,68-69H2,1-2H3,(H2,70,80)(H,72,86)(H,73,83)(H,74,81)(H,75,84)(H,76,85)(H,77,87)(H,78,82)/t51-,53+,54-,55+,56+,57+,58-,59+/m1/s1
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38n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(MOUSE)
BDBM84619
PNG
(BIM 23065 | CAS_150155-63-8 | L-Threoninamide,3-(2...)
Show SMILES C[C@@H](O)[C@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](N)Cc1ccc2ccccc2c1)C(C)O)C(C)O)C(N)=O |r|
Show InChI InChI=1S/C69H83ClN12O13/c1-38(83)58(61(73)87)80-67(93)56(33-41-13-5-4-6-14-41)79-68(94)59(39(2)84)82-69(95)60(40(3)85)81-63(89)53(19-11-12-30-71)75-66(92)57(36-47-37-74-52-18-10-9-17-50(47)52)78-65(91)55(35-43-23-28-49(86)29-24-43)77-64(90)54(34-42-21-26-48(70)27-22-42)76-62(88)51(72)32-44-20-25-45-15-7-8-16-46(45)31-44/h4-10,13-18,20-29,31,37-40,51,53-60,74,83-86H,11-12,19,30,32-36,71-72H2,1-3H3,(H2,73,87)(H,75,92)(H,76,88)(H,77,90)(H,78,91)(H,79,94)(H,80,93)(H,81,89)(H,82,95)/t38-,39?,40?,51-,53-,54+,55?,56-,57+,58+,59+,60+/m1/s1
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40n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(MOUSE)
BDBM82459
PNG
(BIM 23058 | BIM-23058 | D-Phe-L-Phe-L-Tyr-D-Trp-L-...)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(N)=O
Show InChI InChI=1S/C62H77N11O10/c1-37(2)53(62(83)71-51(33-41-21-11-6-12-22-41)61(82)73-54(38(3)74)55(65)76)72-57(78)48(25-15-16-30-63)67-60(81)52(35-43-36-66-47-24-14-13-23-45(43)47)70-59(80)50(34-42-26-28-44(75)29-27-42)69-58(79)49(32-40-19-9-5-10-20-40)68-56(77)46(64)31-39-17-7-4-8-18-39/h4-14,17-24,26-29,36-38,46,48-54,66,74-75H,15-16,25,30-35,63-64H2,1-3H3,(H2,65,76)(H,67,81)(H,68,77)(H,69,79)(H,70,80)(H,71,83)(H,72,78)(H,73,82)/t38-,46-,48+,49+,50+,51+,52-,53+,54+/m1/s1
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46n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(MOUSE)
BDBM82461
PNG
(BIM 23073 | D-Phe-AIa-Tyr-D-Trp-Lys-Val-Ala-D-Nal-...)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccc2ccccc2c1)C(N)=O
Show InChI InChI=1S/C59H73N11O9/c1-34(2)51(59(79)65-36(4)53(73)67-48(52(62)72)31-39-21-24-40-16-8-9-17-41(40)28-39)70-56(76)47(20-12-13-27-60)66-58(78)50(32-42-33-63-46-19-11-10-18-44(42)46)69-57(77)49(30-38-22-25-43(71)26-23-38)68-54(74)35(3)64-55(75)45(61)29-37-14-6-5-7-15-37/h5-11,14-19,21-26,28,33-36,45,47-51,63,71H,12-13,20,27,29-32,60-61H2,1-4H3,(H2,62,72)(H,64,75)(H,65,79)(H,66,78)(H,67,73)(H,68,74)(H,69,77)(H,70,76)/t35-,36-,45+,47-,48+,49-,50+,51-/m0/s1
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60n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM82461
PNG
(BIM 23073 | D-Phe-AIa-Tyr-D-Trp-Lys-Val-Ala-D-Nal-...)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccc2ccccc2c1)C(N)=O
Show InChI InChI=1S/C59H73N11O9/c1-34(2)51(59(79)65-36(4)53(73)67-48(52(62)72)31-39-21-24-40-16-8-9-17-41(40)28-39)70-56(76)47(20-12-13-27-60)66-58(78)50(32-42-33-63-46-19-11-10-18-44(42)46)69-57(77)49(30-38-22-25-43(71)26-23-38)68-54(74)35(3)64-55(75)45(61)29-37-14-6-5-7-15-37/h5-11,14-19,21-26,28,33-36,45,47-51,63,71H,12-13,20,27,29-32,60-61H2,1-4H3,(H2,62,72)(H,64,75)(H,65,79)(H,66,78)(H,67,73)(H,68,74)(H,69,77)(H,70,76)/t35-,36-,45+,47-,48+,49-,50+,51-/m0/s1
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65n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM84626
PNG
(BIM 23034)
Show SMILES CC1NC(=O)C(CCCCN)NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(CSSCC(NC1=O)C(=O)NCc1cccc2ccccc12)NC(=O)C(N)Cc1ccccc1
Show InChI InChI=1S/C55H64N10O8S2/c1-33-49(67)64-47(51(69)59-29-37-16-11-15-36-14-5-6-17-40(36)37)31-74-75-32-48(65-50(68)42(57)26-34-12-3-2-4-13-34)55(73)62-45(27-35-21-23-39(66)24-22-35)53(71)63-46(28-38-30-58-43-19-8-7-18-41(38)43)54(72)61-44(52(70)60-33)20-9-10-25-56/h2-8,11-19,21-24,30,33,42,44-48,58,66H,9-10,20,25-29,31-32,56-57H2,1H3,(H,59,69)(H,60,70)(H,61,72)(H,62,73)(H,63,71)(H,64,67)(H,65,68)
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65n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM84625
PNG
(BIM 23051)
Show SMILES C[C@@H](O)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](N)Cc1ccccc1)C(C)O)C(N)=O
Show InChI InChI=1S/C49H67N11O10/c1-27(54-45(66)35(51)23-31-15-7-5-8-16-31)43(64)57-38(24-32-17-9-6-10-18-32)47(68)58-39(25-33-26-53-36-20-12-11-19-34(33)36)48(69)56-37(21-13-14-22-50)46(67)60-41(30(4)62)49(70)55-28(2)44(65)59-40(29(3)61)42(52)63/h5-12,15-20,26-30,35,37-41,53,61-62H,13-14,21-25,50-51H2,1-4H3,(H2,52,63)(H,54,66)(H,55,70)(H,56,69)(H,57,64)(H,58,68)(H,59,65)(H,60,67)/t27-,28-,29+,30?,35+,37-,38-,39+,40-,41-/m0/s1
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72n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM84642
PNG
(SA IV | c[Ahx-Phe-D-Trp-Lys-Thr(Bzl)])
Show SMILES CC(OCc1ccccc1)C1NC(=O)C(CCCCCCN)NC(=O)C(Cc2ccccc2)NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C(CCCN)NC1=O
Show InChI InChI=1S/C44H58N8O6/c1-29(58-28-31-17-8-5-9-18-31)39-44(57)49-36(22-14-24-46)40(53)51-38(26-32-27-47-34-20-12-11-19-33(32)34)43(56)50-37(25-30-15-6-4-7-16-30)42(55)48-35(41(54)52-39)21-10-2-3-13-23-45/h4-9,11-12,15-20,27,29,35-39,47H,2-3,10,13-14,21-26,28,45-46H2,1H3,(H,48,55)(H,49,57)(H,50,56)(H,51,53)(H,52,54)
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73n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM84644
PNG
(III | SA III | c[Aha-Phe-D-Trp-Lys-Ser(Bzl)])
Show SMILES NCCCCCCCC1NC(=O)C(Cc2ccccc2)NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C(CCCN)NC(=O)C(COCc2ccccc2)NC1=O
Show InChI InChI=1S/C44H58N8O6/c45-23-13-3-1-2-10-21-35-41(54)52-39(29-58-28-31-17-8-5-9-18-31)44(57)49-36(22-14-24-46)40(53)51-38(26-32-27-47-34-20-12-11-19-33(32)34)43(56)50-37(42(55)48-35)25-30-15-6-4-7-16-30/h4-9,11-12,15-20,27,35-39,47H,1-3,10,13-14,21-26,28-29,45-46H2,(H,48,55)(H,49,57)(H,50,56)(H,51,53)(H,52,54)
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80n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM84640
PNG
(BIM 23063)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O
Show InChI InChI=1S/C71H80ClN11O9/c1-43(2)63(71(92)82-61(37-45-17-7-4-8-18-45)67(88)78-58(64(75)85)40-48-24-29-49-19-9-10-20-50(49)35-48)83-66(87)57(23-13-14-34-73)77-70(91)62(41-51-42-76-56-22-12-11-21-54(51)56)81-69(90)60(39-47-27-32-53(84)33-28-47)80-68(89)59(38-46-25-30-52(72)31-26-46)79-65(86)55(74)36-44-15-5-3-6-16-44/h3-12,15-22,24-33,35,42-43,55,57-63,76,84H,13-14,23,34,36-41,73-74H2,1-2H3,(H2,75,85)(H,77,91)(H,78,88)(H,79,86)(H,80,89)(H,81,90)(H,82,92)(H,83,87)/t55-,57+,58+,59+,60+,61+,62-,63+/m1/s1
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81n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(MOUSE)
BDBM82457
PNG
((1R,4S,7S,10R,13S,16R)-4-[(R)-1-Hydroxyethyl]-7-(4...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CSSC[C@H](NC1=O)C(=O)NCCCCCCC(=O)N2
Show InChI InChI=1S/C43H59N9O8S2/c1-26(53)37-43(60)51-34-24-61-62-25-35(47-36(54)18-7-2-3-12-20-45-38(34)55)42(59)49-32(21-27-13-5-4-6-14-27)40(57)50-33(22-28-23-46-30-16-9-8-15-29(28)30)41(58)48-31(39(56)52-37)17-10-11-19-44/h4-6,8-9,13-16,23,26,31-35,37,46,53H,2-3,7,10-12,17-22,24-25,44H2,1H3,(H,45,55)(H,47,54)(H,48,58)(H,49,59)(H,50,57)(H,51,60)(H,52,56)/t26-,31+,32+,33-,34+,35+,37+/m1/s1
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83n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(MOUSE)
BDBM82458
PNG
(BIM 23049 | D-Nal-Ala-Tyr-D-Trp-Lys-Val-Ala-Thr-NH...)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NCc1ccc2ccccc2c1)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(N)=O
Show InChI InChI=1S/C52H68N10O9/c1-29(2)44(52(71)57-31(4)48(67)62-45(32(5)63)46(54)65)61-49(68)41(16-10-11-23-53)58-51(70)43(26-37-28-56-40-15-9-8-14-39(37)40)60-50(69)42(25-33-18-21-38(64)22-19-33)59-47(66)30(3)55-27-34-17-20-35-12-6-7-13-36(35)24-34/h6-9,12-15,17-22,24,28-32,41-45,55-56,63-64H,10-11,16,23,25-27,53H2,1-5H3,(H2,54,65)(H,57,71)(H,58,70)(H,59,66)(H,60,69)(H,61,68)(H,62,67)/t30-,31-,32+,41-,42-,43+,44-,45-/m0/s1
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86n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM84641
PNG
(SA V | c[Aoc-Phe-D-Trp-Lys-Thr(Bzl)])
Show SMILES CC(OCc1ccccc1)C1NC(=O)C(CCCCCCCCN)NC(=O)C(Cc2ccccc2)NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C(CCCN)NC1=O
Show InChI InChI=1S/C46H62N8O6/c1-31(60-30-33-19-10-7-11-20-33)41-46(59)51-38(24-16-26-48)42(55)53-40(28-34-29-49-36-22-14-13-21-35(34)36)45(58)52-39(27-32-17-8-6-9-18-32)44(57)50-37(43(56)54-41)23-12-4-2-3-5-15-25-47/h6-11,13-14,17-22,29,31,37-41,49H,2-5,12,15-16,23-28,30,47-48H2,1H3,(H,50,57)(H,51,59)(H,52,58)(H,53,55)(H,54,56)
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101n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM82471
PNG
(c[Aha-Phe-D-Trp-Lys-Thr(Bzl)] | cycloantagonist SA)
Show SMILES C[C@@H](Oc1ccccc1)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NCCCCCCNC1=O
Show InChI InChI=1S/C42H55N7O5/c1-29(54-32-18-8-5-9-19-32)38-42(53)45-25-15-3-2-14-24-44-36(26-30-16-6-4-7-17-30)40(51)48-37(27-31-28-46-34-21-11-10-20-33(31)34)41(52)47-35(39(50)49-38)22-12-13-23-43/h4-11,16-21,28-29,35-38,44,46H,2-3,12-15,22-27,43H2,1H3,(H,45,53)(H,47,52)(H,48,51)(H,49,50)/t29-,35+,36+,37-,38+/m1/s1
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107n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM50065453
PNG
((5S,8S,11S,14R,17S,19aS)-11-(4-Amino-butyl)-5,17-d...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O
Show InChI InChI=1S/C44H54N8O7/c1-27(53)38-43(58)50-36(24-29-15-6-3-7-16-29)44(59)52-22-12-20-37(52)42(57)49-34(23-28-13-4-2-5-14-28)40(55)48-35(25-30-26-46-32-18-9-8-17-31(30)32)41(56)47-33(39(54)51-38)19-10-11-21-45/h2-9,13-18,26-27,33-38,46,53H,10-12,19-25,45H2,1H3,(H,47,56)(H,48,55)(H,49,57)(H,50,58)(H,51,54)/t27-,33+,34+,35-,36+,37+,38+/m1/s1
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108n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM84638
PNG
(BIM 23070)
Show SMILES CC(O)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cccc2ccccc12)C(N)=O
Show InChI InChI=1S/C58H71N11O10/c1-33(63-54(75)44(60)28-36-14-5-4-6-15-36)53(74)67-48(29-37-23-25-41(71)26-24-37)56(77)68-49(31-40-32-62-45-21-10-9-20-43(40)45)57(78)65-46(22-11-12-27-59)55(76)69-50(35(3)70)58(79)64-34(2)52(73)66-47(51(61)72)30-39-18-13-17-38-16-7-8-19-42(38)39/h4-10,13-21,23-26,32-35,44,46-50,62,70-71H,11-12,22,27-31,59-60H2,1-3H3,(H2,61,72)(H,63,75)(H,64,79)(H,65,78)(H,66,73)(H,67,74)(H,68,77)(H,69,76)/t33-,34-,35?,44+,46-,47-,48-,49+,50-/m0/s1
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111n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM84623
PNG
(NC4-28B)
Show SMILES NCCCCC1NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(CSSCC(NC(=O)C(CO)NC1=O)C(=O)NCc1cccc2ccccc12)NC(=O)C(N)Cc1ccccc1
Show InChI InChI=1S/C55H64N10O9S2/c56-24-9-8-19-43-51(70)63-46(30-66)54(73)65-47(50(69)59-28-36-15-10-14-35-13-4-5-16-39(35)36)31-75-76-32-48(64-49(68)41(57)25-33-11-2-1-3-12-33)55(74)61-44(26-34-20-22-38(67)23-21-34)52(71)62-45(53(72)60-43)27-37-29-58-42-18-7-6-17-40(37)42/h1-7,10-18,20-23,29,41,43-48,58,66-67H,8-9,19,24-28,30-32,56-57H2,(H,59,69)(H,60,72)(H,61,74)(H,62,71)(H,63,70)(H,64,68)(H,65,73)
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112n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM84627
PNG
(BIM 23067)
Show SMILES CC[C@H](NC(=O)[C@H](N)Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C56H72ClN11O9/c1-5-42(63-51(72)41(59)27-35-18-22-38(57)23-19-35)52(73)66-46(29-36-20-24-39(69)25-21-36)54(75)67-47(30-37-31-61-43-16-10-9-15-40(37)43)55(76)64-44(17-11-12-26-58)53(74)68-48(32(2)3)56(77)62-33(4)50(71)65-45(49(60)70)28-34-13-7-6-8-14-34/h6-10,13-16,18-25,31-33,41-42,44-48,61,69H,5,11-12,17,26-30,58-59H2,1-4H3,(H2,60,70)(H,62,77)(H,63,72)(H,64,76)(H,65,71)(H,66,73)(H,67,75)(H,68,74)/t33-,41+,42-,44-,45+,46-,47+,48-/m0/s1
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123n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM82456
PNG
(BIM 23030 | CAS_117580-24-2)
Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC(NC1=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C45H57N9O8S2/c1-26(2)38-43(61)54-45(44(62)51-34(39(47)57)22-27-10-4-3-5-11-27)64-63-21-19-37(56)49-35(23-28-15-17-30(55)18-16-28)41(59)52-36(24-29-25-48-32-13-7-6-12-31(29)32)42(60)50-33(40(58)53-38)14-8-9-20-46/h3-7,10-13,15-18,25-26,33-36,38,45,48,55H,8-9,14,19-24,46H2,1-2H3,(H2,47,57)(H,49,56)(H,50,60)(H,51,62)(H,52,59)(H,53,58)(H,54,61)/t33-,34-,35-,36+,38-,45?/m0/s1
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133n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(MOUSE)
BDBM84627
PNG
(BIM 23067)
Show SMILES CC[C@H](NC(=O)[C@H](N)Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C56H72ClN11O9/c1-5-42(63-51(72)41(59)27-35-18-22-38(57)23-19-35)52(73)66-46(29-36-20-24-39(69)25-21-36)54(75)67-47(30-37-31-61-43-16-10-9-15-40(37)43)55(76)64-44(17-11-12-26-58)53(74)68-48(32(2)3)56(77)62-33(4)50(71)65-45(49(60)70)28-34-13-7-6-8-14-34/h6-10,13-16,18-25,31-33,41-42,44-48,61,69H,5,11-12,17,26-30,58-59H2,1-4H3,(H2,60,70)(H,62,77)(H,63,72)(H,64,76)(H,65,71)(H,66,73)(H,67,75)(H,68,74)/t33-,41+,42-,44-,45+,46-,47+,48-/m0/s1
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135n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM82471
PNG
(c[Aha-Phe-D-Trp-Lys-Thr(Bzl)] | cycloantagonist SA)
Show SMILES C[C@@H](Oc1ccccc1)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NCCCCCCNC1=O
Show InChI InChI=1S/C42H55N7O5/c1-29(54-32-18-8-5-9-19-32)38-42(53)45-25-15-3-2-14-24-44-36(26-30-16-6-4-7-17-30)40(51)48-37(27-31-28-46-34-21-11-10-20-33(31)34)41(52)47-35(39(50)49-38)22-12-13-23-43/h4-11,16-21,28-29,35-38,44,46H,2-3,12-15,22-27,43H2,1H3,(H,45,53)(H,47,52)(H,48,51)(H,49,50)/t29-,35+,36+,37-,38+/m1/s1
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141n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM84616
PNG
(BIM 23069 | CAS_150155-67-2 | L-Alaninamide,4-chlo...)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](N)Cc1ccc(Cl)cc1)C(=O)N[C@@H](C)C(C)=O |r|
Show InChI InChI=1S/C47H62ClN9O8/c1-26(2)41(47(65)52-27(3)29(5)58)57-44(62)38(12-8-9-21-49)54-46(64)40(24-32-25-51-37-11-7-6-10-35(32)37)56-45(63)39(23-31-15-19-34(59)20-16-31)55-42(60)28(4)53-43(61)36(50)22-30-13-17-33(48)18-14-30/h6-7,10-11,13-20,25-28,36,38-41,51,59H,8-9,12,21-24,49-50H2,1-5H3,(H,52,65)(H,53,61)(H,54,64)(H,55,60)(H,56,63)(H,57,62)/t27-,28-,36+,38-,39-,40+,41-/m0/s1
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143n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM82461
PNG
(BIM 23073 | D-Phe-AIa-Tyr-D-Trp-Lys-Val-Ala-D-Nal-...)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1ccc2ccccc2c1)C(N)=O
Show InChI InChI=1S/C59H73N11O9/c1-34(2)51(59(79)65-36(4)53(73)67-48(52(62)72)31-39-21-24-40-16-8-9-17-41(40)28-39)70-56(76)47(20-12-13-27-60)66-58(78)50(32-42-33-63-46-19-11-10-18-44(42)46)69-57(77)49(30-38-22-25-43(71)26-23-38)68-54(74)35(3)64-55(75)45(61)29-37-14-6-5-7-15-37/h5-11,14-19,21-26,28,33-36,45,47-51,63,71H,12-13,20,27,29-32,60-61H2,1-4H3,(H2,62,72)(H,64,75)(H,65,79)(H,66,78)(H,67,73)(H,68,74)(H,69,77)(H,70,76)/t35-,36-,45+,47-,48+,49-,50+,51-/m0/s1
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146n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM84617
PNG
(BIM 23053 | CAS_150155-59-2 | L-Alaninamide,D-phen...)
Show SMILES CC[C@H](NC(=O)[C@H](N)Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O |r|
Show InChI InChI=1S/C60H74ClN11O8/c1-5-46(67-55(75)45(63)30-38-23-26-43(61)27-24-38)56(76)70-50(31-37-15-7-6-8-16-37)58(78)71-51(33-42-34-65-47-20-12-11-19-44(42)47)59(79)68-48(21-13-14-28-62)57(77)72-52(35(2)3)60(80)66-36(4)54(74)69-49(53(64)73)32-39-22-25-40-17-9-10-18-41(40)29-39/h6-12,15-20,22-27,29,34-36,45-46,48-52,65H,5,13-14,21,28,30-33,62-63H2,1-4H3,(H2,64,73)(H,66,80)(H,67,75)(H,68,79)(H,69,74)(H,70,76)(H,71,78)(H,72,77)/t36-,45+,46-,48-,49-,50-,51+,52-/m0/s1
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152n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM84620
PNG
(DC23-60)
Show SMILES CC(C)C1NC(=O)C(CCCCN)NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(CSSCC(NC1=O)C(=O)NC(CO)C(C)O)NC(=O)C(N)Cc1cccc2ccccc12
Show InChI InChI=1S/C54H70N10O10S2/c1-30(2)47-54(74)63-46(53(73)61-44(27-65)31(3)66)29-76-75-28-45(62-48(68)39(56)24-34-13-10-12-33-11-4-5-14-37(33)34)52(72)59-42(23-32-18-20-36(67)21-19-32)50(70)60-43(25-35-26-57-40-16-7-6-15-38(35)40)51(71)58-41(49(69)64-47)17-8-9-22-55/h4-7,10-16,18-21,26,30-31,39,41-47,57,65-67H,8-9,17,22-25,27-29,55-56H2,1-3H3,(H,58,71)(H,59,72)(H,60,70)(H,61,73)(H,62,68)(H,63,74)(H,64,69)
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166n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM84642
PNG
(SA IV | c[Ahx-Phe-D-Trp-Lys-Thr(Bzl)])
Show SMILES CC(OCc1ccccc1)C1NC(=O)C(CCCCCCN)NC(=O)C(Cc2ccccc2)NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C(CCCN)NC1=O
Show InChI InChI=1S/C44H58N8O6/c1-29(58-28-31-17-8-5-9-18-31)39-44(57)49-36(22-14-24-46)40(53)51-38(26-32-27-47-34-20-12-11-19-33(32)34)43(56)50-37(25-30-15-6-4-7-16-30)42(55)48-35(41(54)52-39)21-10-2-3-13-23-45/h4-9,11-12,15-20,27,29,35-39,47H,2-3,10,13-14,21-26,28,45-46H2,1H3,(H,48,55)(H,49,57)(H,50,56)(H,51,53)(H,52,54)
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183n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM84621
PNG
(BIM 23042)
Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)C(NC(=O)C(N)Cc2ccc3ccccc3c2)SSC(NC1=O)C(=O)NC(Cc1ccc2ccccc2c1)C(N)=O |r|
Show InChI InChI=1S/C61H69N11O9S2/c1-34(2)51-57(79)72-61(58(80)67-48(52(64)74)31-37-19-23-39-12-4-6-14-41(39)28-37)83-82-60(71-53(75)45(63)29-36-18-22-38-11-3-5-13-40(38)27-36)59(81)69-49(30-35-20-24-43(73)25-21-35)55(77)68-50(32-42-33-65-46-16-8-7-15-44(42)46)56(78)66-47(54(76)70-51)17-9-10-26-62/h3-8,11-16,18-25,27-28,33-34,45,47-51,60-61,65,73H,9-10,17,26,29-32,62-63H2,1-2H3,(H2,64,74)(H,66,78)(H,67,80)(H,68,77)(H,69,81)(H,70,76)(H,71,75)(H,72,79)/t45?,47-,48?,49-,50+,51-,60?,61?/m0/s1
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207n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM84644
PNG
(III | SA III | c[Aha-Phe-D-Trp-Lys-Ser(Bzl)])
Show SMILES NCCCCCCCC1NC(=O)C(Cc2ccccc2)NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C(CCCN)NC(=O)C(COCc2ccccc2)NC1=O
Show InChI InChI=1S/C44H58N8O6/c45-23-13-3-1-2-10-21-35-41(54)52-39(29-58-28-31-17-8-5-9-18-31)44(57)49-36(22-14-24-46)40(53)51-38(26-32-27-47-34-20-12-11-19-33(32)34)43(56)50-37(42(55)48-35)25-30-15-6-4-7-16-30/h4-9,11-12,15-20,27,35-39,47H,1-3,10,13-14,21-26,28-29,45-46H2,(H,48,55)(H,49,57)(H,50,56)(H,51,53)(H,52,54)
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214n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM84620
PNG
(DC23-60)
Show SMILES CC(C)C1NC(=O)C(CCCCN)NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(CSSCC(NC1=O)C(=O)NC(CO)C(C)O)NC(=O)C(N)Cc1cccc2ccccc12
Show InChI InChI=1S/C54H70N10O10S2/c1-30(2)47-54(74)63-46(53(73)61-44(27-65)31(3)66)29-76-75-28-45(62-48(68)39(56)24-34-13-10-12-33-11-4-5-14-37(33)34)52(72)59-42(23-32-18-20-36(67)21-19-32)50(70)60-43(25-35-26-57-40-16-7-6-15-38(35)40)51(71)58-41(49(69)64-47)17-8-9-22-55/h4-7,10-16,18-21,26,30-31,39,41-47,57,65-67H,8-9,17,22-25,27-29,55-56H2,1-3H3,(H,58,71)(H,59,72)(H,60,70)(H,61,73)(H,62,68)(H,63,74)(H,64,69)
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241n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(MOUSE)
BDBM84645
PNG
(L-363,376 | cyclo(Pro-Ala-Trp-Lys-Thr-Phe))
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O
Show InChI InChI=1S/C38H50N8O7/c1-22-33(48)43-29(20-25-21-40-27-14-7-6-13-26(25)27)35(50)42-28(15-8-9-17-39)34(49)45-32(23(2)47)37(52)44-30(19-24-11-4-3-5-12-24)38(53)46-18-10-16-31(46)36(51)41-22/h3-7,11-14,21-23,28-32,40,47H,8-10,15-20,39H2,1-2H3,(H,41,51)(H,42,50)(H,43,48)(H,44,52)(H,45,49)/t22-,23+,28-,29+,30-,31-,32-/m0/s1
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244n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(MOUSE)
BDBM84640
PNG
(BIM 23063)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O
Show InChI InChI=1S/C71H80ClN11O9/c1-43(2)63(71(92)82-61(37-45-17-7-4-8-18-45)67(88)78-58(64(75)85)40-48-24-29-49-19-9-10-20-50(49)35-48)83-66(87)57(23-13-14-34-73)77-70(91)62(41-51-42-76-56-22-12-11-21-54(51)56)81-69(90)60(39-47-27-32-53(84)33-28-47)80-68(89)59(38-46-25-30-52(72)31-26-46)79-65(86)55(74)36-44-15-5-3-6-16-44/h3-12,15-22,24-33,35,42-43,55,57-63,76,84H,13-14,23,34,36-41,73-74H2,1-2H3,(H2,75,85)(H,77,91)(H,78,88)(H,79,86)(H,80,89)(H,81,90)(H,82,92)(H,83,87)/t55-,57+,58+,59+,60+,61+,62-,63+/m1/s1
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248n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(MOUSE)
BDBM84645
PNG
(L-363,376 | cyclo(Pro-Ala-Trp-Lys-Thr-Phe))
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O
Show InChI InChI=1S/C38H50N8O7/c1-22-33(48)43-29(20-25-21-40-27-14-7-6-13-26(25)27)35(50)42-28(15-8-9-17-39)34(49)45-32(23(2)47)37(52)44-30(19-24-11-4-3-5-12-24)38(53)46-18-10-16-31(46)36(51)41-22/h3-7,11-14,21-23,28-32,40,47H,8-10,15-20,39H2,1-2H3,(H,41,51)(H,42,50)(H,43,48)(H,44,52)(H,45,49)/t22-,23+,28-,29+,30-,31-,32-/m0/s1
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356n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM84628
PNG
(EC5-21)
Show SMILES CC(O)C1NC(=O)C(CCCCN)NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C(Cc2ccccc2)NC(=O)C(CSSCC(NC1=O)C(=O)NCc1cccc2ccccc12)NC(=O)C(N)Cc1ccccc1
Show InChI InChI=1S/C56H66N10O8S2/c1-34(67)49-56(74)65-47(51(69)60-30-38-21-14-20-37-19-8-9-22-40(37)38)32-75-76-33-48(64-50(68)42(58)27-35-15-4-2-5-16-35)55(73)62-45(28-36-17-6-3-7-18-36)53(71)63-46(29-39-31-59-43-24-11-10-23-41(39)43)54(72)61-44(52(70)66-49)25-12-13-26-57/h2-11,14-24,31,34,42,44-49,59,67H,12-13,25-30,32-33,57-58H2,1H3,(H,60,69)(H,61,72)(H,62,73)(H,63,71)(H,64,68)(H,65,74)(H,66,70)
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382n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM50063819
PNG
(BIM 23050 | CHEMBL413535 | cyclo[NMeDAla-Tyr-DTrp-...)
Show SMILES CC(C)[C@@H]1NC(=O)[C@@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@@H](C)N(C)C(=O)[C@@H](Cc2ccccc2)NC1=O
Show InChI InChI=1S/C44H56N8O7/c1-26(2)38-43(58)50-37(23-28-12-6-5-7-13-28)44(59)52(4)27(3)39(54)48-35(22-29-17-19-31(53)20-18-29)41(56)49-36(24-30-25-46-33-15-9-8-14-32(30)33)42(57)47-34(40(55)51-38)16-10-11-21-45/h5-9,12-15,17-20,25-27,34-38,46,53H,10-11,16,21-24,45H2,1-4H3,(H,47,57)(H,48,54)(H,49,56)(H,50,58)(H,51,55)/t27-,34-,35-,36-,37-,38+/m1/s1
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419n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM82466
PNG
(L-362,862 | L-362862 | c[Aha-Phe-p-C1-Phe-D-Trp-Ly...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CCCCCCNC(=O)[C@H](Cc2ccccc2)NC1=O
Show InChI InChI=1S/C55H68ClN9O8/c1-35(66)49-55(73)64-44(30-36-16-6-4-7-17-36)50(68)58-29-15-3-2-10-23-48(67)60-45(32-38-24-26-40(56)27-25-38)52(70)62-46(31-37-18-8-5-9-19-37)53(71)63-47(33-39-34-59-42-21-12-11-20-41(39)42)54(72)61-43(51(69)65-49)22-13-14-28-57/h4-9,11-12,16-21,24-27,34-35,43-47,49,59,66H,2-3,10,13-15,22-23,28-33,57H2,1H3,(H,58,68)(H,60,67)(H,61,72)(H,62,70)(H,63,71)(H,64,73)(H,65,69)/t35-,43+,44+,45+,46+,47-,49+/m1/s1
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580n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM84641
PNG
(SA V | c[Aoc-Phe-D-Trp-Lys-Thr(Bzl)])
Show SMILES CC(OCc1ccccc1)C1NC(=O)C(CCCCCCCCN)NC(=O)C(Cc2ccccc2)NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C(CCCN)NC1=O
Show InChI InChI=1S/C46H62N8O6/c1-31(60-30-33-19-10-7-11-20-33)41-46(59)51-38(24-16-26-48)42(55)53-40(28-34-29-49-36-22-14-13-21-35(34)36)45(58)52-39(27-32-17-8-6-9-18-32)44(57)50-37(43(56)54-41)23-12-4-2-3-5-15-25-47/h6-11,13-14,17-22,29,31,37-41,49H,2-5,12,15-16,23-28,30,47-48H2,1H3,(H,50,57)(H,51,59)(H,52,58)(H,53,55)(H,54,56)
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700n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM82470
PNG
(3-(2-Naphtyl)-D-Ala-L-Cys(1)-L-Tyr-D-Trp-L-Lys-L-V...)
Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)N[C@@H]([C@@H](C)O)C(N)=O)NC(=O)[C@H](N)Cc1ccc2ccccc2c1
Show InChI InChI=1S/C54H69N11O10S2/c1-29(2)45-54(75)63-44(53(74)65-46(30(3)66)47(57)68)28-77-76-27-43(62-48(69)38(56)23-32-15-18-33-10-4-5-11-34(33)22-32)52(73)60-41(24-31-16-19-36(67)20-17-31)50(71)61-42(25-35-26-58-39-13-7-6-12-37(35)39)51(72)59-40(49(70)64-45)14-8-9-21-55/h4-7,10-13,15-20,22,26,29-30,38,40-46,58,66-67H,8-9,14,21,23-25,27-28,55-56H2,1-3H3,(H2,57,68)(H,59,72)(H,60,73)(H,61,71)(H,62,69)(H,63,75)(H,64,70)(H,65,74)/t30-,38-,40+,41+,42-,43+,44+,45+,46+/m1/s1
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789n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(MOUSE)
BDBM84625
PNG
(BIM 23051)
Show SMILES C[C@@H](O)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](N)Cc1ccccc1)C(C)O)C(N)=O
Show InChI InChI=1S/C49H67N11O10/c1-27(54-45(66)35(51)23-31-15-7-5-8-16-31)43(64)57-38(24-32-17-9-6-10-18-32)47(68)58-39(25-33-26-53-36-20-12-11-19-34(33)36)48(69)56-37(21-13-14-22-50)46(67)60-41(30(4)62)49(70)55-28(2)44(65)59-40(29(3)61)42(52)63/h5-12,15-20,26-30,35,37-41,53,61-62H,13-14,21-25,50-51H2,1-4H3,(H2,52,63)(H,54,66)(H,55,70)(H,56,69)(H,57,64)(H,58,68)(H,59,65)(H,60,67)/t27-,28-,29+,30?,35+,37-,38-,39+,40-,41-/m0/s1
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836n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 2


(MOUSE)
BDBM84643
PNG
(BIM 23064)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C(N)=O
Show InChI InChI=1S/C61H74ClN11O9/c1-36(2)53(61(82)72-49(31-39-16-8-5-9-17-39)57(78)67-37(3)54(65)75)73-56(77)48(20-12-13-29-63)68-60(81)52(34-42-35-66-47-19-11-10-18-45(42)47)71-59(80)51(33-41-23-27-44(74)28-24-41)70-58(79)50(32-40-21-25-43(62)26-22-40)69-55(76)46(64)30-38-14-6-4-7-15-38/h4-11,14-19,21-28,35-37,46,48-53,66,74H,12-13,20,29-34,63-64H2,1-3H3,(H2,65,75)(H,67,78)(H,68,81)(H,69,76)(H,70,79)(H,71,80)(H,72,82)(H,73,77)/t37-,46-,48+,49+,50+,51+,52-,53+/m1/s1
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948n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM82456
PNG
(BIM 23030 | CAS_117580-24-2)
Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC(NC1=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C45H57N9O8S2/c1-26(2)38-43(61)54-45(44(62)51-34(39(47)57)22-27-10-4-3-5-11-27)64-63-21-19-37(56)49-35(23-28-15-17-30(55)18-16-28)41(59)52-36(24-29-25-48-32-13-7-6-12-31(29)32)42(60)50-33(40(58)53-38)14-8-9-20-46/h3-7,10-13,15-18,25-26,33-36,38,45,48,55H,8-9,14,19-24,46H2,1-2H3,(H2,47,57)(H,49,56)(H,50,60)(H,51,62)(H,52,59)(H,53,58)(H,54,61)/t33-,34-,35-,36+,38-,45?/m0/s1
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1.00E+3n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM84626
PNG
(BIM 23034)
Show SMILES CC1NC(=O)C(CCCCN)NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(CSSCC(NC1=O)C(=O)NCc1cccc2ccccc12)NC(=O)C(N)Cc1ccccc1
Show InChI InChI=1S/C55H64N10O8S2/c1-33-49(67)64-47(51(69)59-29-37-16-11-15-36-14-5-6-17-40(36)37)31-74-75-32-48(65-50(68)42(57)26-34-12-3-2-4-13-34)55(73)62-45(27-35-21-23-39(66)24-22-35)53(71)63-46(28-38-30-58-43-19-8-7-18-41(38)43)54(72)61-44(52(70)60-33)20-9-10-25-56/h2-8,11-19,21-24,30,33,42,44-48,58,66H,9-10,20,25-29,31-32,56-57H2,1H3,(H,59,69)(H,60,70)(H,61,72)(H,62,73)(H,63,71)(H,64,67)(H,65,68)
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1.00E+3n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM84621
PNG
(BIM 23042)
Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)C(NC(=O)C(N)Cc2ccc3ccccc3c2)SSC(NC1=O)C(=O)NC(Cc1ccc2ccccc2c1)C(N)=O |r|
Show InChI InChI=1S/C61H69N11O9S2/c1-34(2)51-57(79)72-61(58(80)67-48(52(64)74)31-37-19-23-39-12-4-6-14-41(39)28-37)83-82-60(71-53(75)45(63)29-36-18-22-38-11-3-5-13-40(38)27-36)59(81)69-49(30-35-20-24-43(73)25-21-35)55(77)68-50(32-42-33-65-46-16-8-7-15-44(42)46)56(78)66-47(54(76)70-51)17-9-10-26-62/h3-8,11-16,18-25,27-28,33-34,45,47-51,60-61,65,73H,9-10,17,26,29-32,62-63H2,1-2H3,(H2,64,74)(H,66,78)(H,67,80)(H,68,77)(H,69,81)(H,70,76)(H,71,75)(H,72,79)/t45?,47-,48?,49-,50+,51-,60?,61?/m0/s1
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1.00E+3n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




Mol Pharmacol 43: 838-44 (1993)


BindingDB Entry DOI: 10.7270/Q21N7ZN7
More data for this
Ligand-Target Pair
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