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BDBM84987 RC 160II

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(Cc1c[nH]c2ccccc12)C(N)=O)NC(=O)CN(Cc1ccccc1)C(C)=O

InChI Key: InChIKey=ONRUMWSSIPZFLI-UHFFFAOYSA-N

Data: 5 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 84987   
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
Somatostatin receptor type 2


(Homo sapiens (Human))
BDBM84987
PNG
(RC 160II)
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(Cc1c[nH]c2ccccc12)C(N)=O)NC(=O)CN(Cc1ccccc1)C(C)=O
Show InChI InChI=1S/C59H72N12O10S2/c1-34(2)52-59(81)69-50(58(80)66-46(53(61)75)26-38-28-62-43-17-9-7-15-41(38)43)33-83-82-32-49(64-51(74)31-71(35(3)72)30-37-13-5-4-6-14-37)57(79)67-47(25-36-20-22-40(73)23-21-36)55(77)68-48(27-39-29-63-44-18-10-8-16-42(39)44)56(78)65-45(54(76)70-52)19-11-12-24-60/h4-10,13-18,20-23,28-29,34,45-50,52,62-63,73H,11-12,19,24-27,30-33,60H2,1-3H3,(H2,61,75)(H,64,74)(H,65,78)(H,66,80)(H,67,79)(H,68,77)(H,69,81)(H,70,76)
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PubMed
1.58n/an/an/an/an/an/an/an/a



Sandoz Pharma Ltd

Curated by PDSP Ki Database




Metab Clin Exp 45: 17-20 (1996)


Article DOI: 10.1016/s0026-0495(96)90072-4
BindingDB Entry DOI: 10.7270/Q2WQ02B7
More data for this
Ligand-Target Pair
Somatostatin receptor type 5


(Homo sapiens (Human))
BDBM84987
PNG
(RC 160II)
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(Cc1c[nH]c2ccccc12)C(N)=O)NC(=O)CN(Cc1ccccc1)C(C)=O
Show InChI InChI=1S/C59H72N12O10S2/c1-34(2)52-59(81)69-50(58(80)66-46(53(61)75)26-38-28-62-43-17-9-7-15-41(38)43)33-83-82-32-49(64-51(74)31-71(35(3)72)30-37-13-5-4-6-14-37)57(79)67-47(25-36-20-22-40(73)23-21-36)55(77)68-48(27-39-29-63-44-18-10-8-16-42(39)44)56(78)65-45(54(76)70-52)19-11-12-24-60/h4-10,13-18,20-23,28-29,34,45-50,52,62-63,73H,11-12,19,24-27,30-33,60H2,1-3H3,(H2,61,75)(H,64,74)(H,65,78)(H,66,80)(H,67,79)(H,68,77)(H,69,81)(H,70,76)
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PubMed
5.01n/an/an/an/an/an/an/an/a



Sandoz Pharma Ltd

Curated by PDSP Ki Database




Metab Clin Exp 45: 17-20 (1996)


Article DOI: 10.1016/s0026-0495(96)90072-4
BindingDB Entry DOI: 10.7270/Q2WQ02B7
More data for this
Ligand-Target Pair
Somatostatin receptor type 4


(Homo sapiens (Human))
BDBM84987
PNG
(RC 160II)
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(Cc1c[nH]c2ccccc12)C(N)=O)NC(=O)CN(Cc1ccccc1)C(C)=O
Show InChI InChI=1S/C59H72N12O10S2/c1-34(2)52-59(81)69-50(58(80)66-46(53(61)75)26-38-28-62-43-17-9-7-15-41(38)43)33-83-82-32-49(64-51(74)31-71(35(3)72)30-37-13-5-4-6-14-37)57(79)67-47(25-36-20-22-40(73)23-21-36)55(77)68-48(27-39-29-63-44-18-10-8-16-42(39)44)56(78)65-45(54(76)70-52)19-11-12-24-60/h4-10,13-18,20-23,28-29,34,45-50,52,62-63,73H,11-12,19,24-27,30-33,60H2,1-3H3,(H2,61,75)(H,64,74)(H,65,78)(H,66,80)(H,67,79)(H,68,77)(H,69,81)(H,70,76)
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PubMed
100n/an/an/an/an/an/an/an/a



Sandoz Pharma Ltd

Curated by PDSP Ki Database




Metab Clin Exp 45: 17-20 (1996)


Article DOI: 10.1016/s0026-0495(96)90072-4
BindingDB Entry DOI: 10.7270/Q2WQ02B7
More data for this
Ligand-Target Pair
Somatostatin receptor type 1


(Homo sapiens (Human))
BDBM84987
PNG
(RC 160II)
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(Cc1c[nH]c2ccccc12)C(N)=O)NC(=O)CN(Cc1ccccc1)C(C)=O
Show InChI InChI=1S/C59H72N12O10S2/c1-34(2)52-59(81)69-50(58(80)66-46(53(61)75)26-38-28-62-43-17-9-7-15-41(38)43)33-83-82-32-49(64-51(74)31-71(35(3)72)30-37-13-5-4-6-14-37)57(79)67-47(25-36-20-22-40(73)23-21-36)55(77)68-48(27-39-29-63-44-18-10-8-16-42(39)44)56(78)65-45(54(76)70-52)19-11-12-24-60/h4-10,13-18,20-23,28-29,34,45-50,52,62-63,73H,11-12,19,24-27,30-33,60H2,1-3H3,(H2,61,75)(H,64,74)(H,65,78)(H,66,80)(H,67,79)(H,68,77)(H,69,81)(H,70,76)
KEGG

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PC cid
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Article
PubMed
100n/an/an/an/an/an/an/an/a



Sandoz Pharma Ltd

Curated by PDSP Ki Database




Metab Clin Exp 45: 17-20 (1996)


Article DOI: 10.1016/s0026-0495(96)90072-4
BindingDB Entry DOI: 10.7270/Q2WQ02B7
More data for this
Ligand-Target Pair
Somatostatin receptor type 3


(Homo sapiens (Human))
BDBM84987
PNG
(RC 160II)
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(Cc1c[nH]c2ccccc12)C(N)=O)NC(=O)CN(Cc1ccccc1)C(C)=O
Show InChI InChI=1S/C59H72N12O10S2/c1-34(2)52-59(81)69-50(58(80)66-46(53(61)75)26-38-28-62-43-17-9-7-15-41(38)43)33-83-82-32-49(64-51(74)31-71(35(3)72)30-37-13-5-4-6-14-37)57(79)67-47(25-36-20-22-40(73)23-21-36)55(77)68-48(27-39-29-63-44-18-10-8-16-42(39)44)56(78)65-45(54(76)70-52)19-11-12-24-60/h4-10,13-18,20-23,28-29,34,45-50,52,62-63,73H,11-12,19,24-27,30-33,60H2,1-3H3,(H2,61,75)(H,64,74)(H,65,78)(H,66,80)(H,67,79)(H,68,77)(H,69,81)(H,70,76)
Reactome pathway
KEGG

UniProtKB/SwissProt

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GoogleScholar
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UniChem

Similars

Article
PubMed
100n/an/an/an/an/an/an/an/a



Sandoz Pharma Ltd

Curated by PDSP Ki Database




Metab Clin Exp 45: 17-20 (1996)


Article DOI: 10.1016/s0026-0495(96)90072-4
BindingDB Entry DOI: 10.7270/Q2WQ02B7
More data for this
Ligand-Target Pair