BDBM50136790 (4R,7S,10R,13S,16S,19S,22R,25S)-13-(4-Amino-butyl)-19,22-dibenzyl-7-(4-hydroxy-benzyl)-10-((R)-1-hydroxy-ethyl)-16-(1H-indol-3-ylmethyl)-6,9,12,15,18,21,24-heptaoxo-25-ureido-1,2-dithia-5,8,11,14,17,20,23-heptaaza-cyclohexacosane-4-carboxylic acid::CHEMBL438895

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](Cc2ccccc2)NC(=O)[C@@H](CSSC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(O)=O)NC(N)=O

InChI Key: InChIKey=PINPTEGBOBLHFX-UWQUZNCTSA-N

Data: 5 IC50

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 = 50136790   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Somatostatin receptor type 1 (Homo sapiens (Human))	BDBM50136790 ((4R,7S,10R,13S,16S,19S,22R,25S)-13-(4-Amino-butyl)...) 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](Cc2ccccc2)NC(=O)[C@@H](CSSC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(O)=O)NC(N)=O Show InChI InChI=1S/C55H67N11O12S2/c1-31(67)46-53(75)63-42(26-34-19-21-36(68)22-20-34)50(72)64-45(54(76)77)30-80-79-29-44(65-55(57)78)52(74)61-41(25-33-14-6-3-7-15-33)48(70)60-40(24-32-12-4-2-5-13-32)49(71)62-43(27-35-28-58-38-17-9-8-16-37(35)38)51(73)59-39(47(69)66-46)18-10-11-23-56/h2-9,12-17,19-22,28,31,39-46,58,67-68H,10-11,18,23-27,29-30,56H2,1H3,(H,59,73)(H,60,70)(H,61,74)(H,62,71)(H,63,75)(H,64,72)(H,66,69)(H,76,77)(H3,57,65,78)/t31-,39+,40+,41-,42+,43+,44-,45+,46-/m1/s1	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
Salk Institute Curated by ChEMBL					Assay Description Binding affinity towards human somatostatin receptor type 1 using [125I]-[Leu8,DTrp22,Tyr25]SRIF-28 as radioligand.				J Med Chem 46: 5597-605 (2003) Article DOI: 10.1021/jm030245x BindingDB Entry DOI: 10.7270/Q2MK6C9X
					More data for this Ligand-Target Pair
Somatostatin receptor type 5 (Homo sapiens (Human))	BDBM50136790 ((4R,7S,10R,13S,16S,19S,22R,25S)-13-(4-Amino-butyl)...) 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](Cc2ccccc2)NC(=O)[C@@H](CSSC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(O)=O)NC(N)=O Show InChI InChI=1S/C55H67N11O12S2/c1-31(67)46-53(75)63-42(26-34-19-21-36(68)22-20-34)50(72)64-45(54(76)77)30-80-79-29-44(65-55(57)78)52(74)61-41(25-33-14-6-3-7-15-33)48(70)60-40(24-32-12-4-2-5-13-32)49(71)62-43(27-35-28-58-38-17-9-8-16-37(35)38)51(73)59-39(47(69)66-46)18-10-11-23-56/h2-9,12-17,19-22,28,31,39-46,58,67-68H,10-11,18,23-27,29-30,56H2,1H3,(H,59,73)(H,60,70)(H,61,74)(H,62,71)(H,63,75)(H,64,72)(H,66,69)(H,76,77)(H3,57,65,78)/t31-,39+,40+,41-,42+,43+,44-,45+,46-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.60	n/a	n/a	n/a	n/a	n/a	n/a
Salk Institute Curated by ChEMBL					Assay Description Binding affinity towards human somatostatin receptor type 5 using [125I]-[Leu8,DTrp22,Tyr25]SRIF-28 as radioligand.				J Med Chem 46: 5597-605 (2003) Article DOI: 10.1021/jm030245x BindingDB Entry DOI: 10.7270/Q2MK6C9X
					More data for this Ligand-Target Pair
Somatostatin receptor type 3 (Homo sapiens (Human))	BDBM50136790 ((4R,7S,10R,13S,16S,19S,22R,25S)-13-(4-Amino-butyl)...) 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](Cc2ccccc2)NC(=O)[C@@H](CSSC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(O)=O)NC(N)=O Show InChI InChI=1S/C55H67N11O12S2/c1-31(67)46-53(75)63-42(26-34-19-21-36(68)22-20-34)50(72)64-45(54(76)77)30-80-79-29-44(65-55(57)78)52(74)61-41(25-33-14-6-3-7-15-33)48(70)60-40(24-32-12-4-2-5-13-32)49(71)62-43(27-35-28-58-38-17-9-8-16-37(35)38)51(73)59-39(47(69)66-46)18-10-11-23-56/h2-9,12-17,19-22,28,31,39-46,58,67-68H,10-11,18,23-27,29-30,56H2,1H3,(H,59,73)(H,60,70)(H,61,74)(H,62,71)(H,63,75)(H,64,72)(H,66,69)(H,76,77)(H3,57,65,78)/t31-,39+,40+,41-,42+,43+,44-,45+,46-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Salk Institute Curated by ChEMBL					Assay Description Binding affinity towards human somatostatin receptor type 3 using [125I]-[Leu8,DTrp22,Tyr25]SRIF-28 as radioligand.				J Med Chem 46: 5597-605 (2003) Article DOI: 10.1021/jm030245x BindingDB Entry DOI: 10.7270/Q2MK6C9X
					More data for this Ligand-Target Pair
Somatostatin receptor type 4 (Homo sapiens (Human))	BDBM50136790 ((4R,7S,10R,13S,16S,19S,22R,25S)-13-(4-Amino-butyl)...) 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](Cc2ccccc2)NC(=O)[C@@H](CSSC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(O)=O)NC(N)=O Show InChI InChI=1S/C55H67N11O12S2/c1-31(67)46-53(75)63-42(26-34-19-21-36(68)22-20-34)50(72)64-45(54(76)77)30-80-79-29-44(65-55(57)78)52(74)61-41(25-33-14-6-3-7-15-33)48(70)60-40(24-32-12-4-2-5-13-32)49(71)62-43(27-35-28-58-38-17-9-8-16-37(35)38)51(73)59-39(47(69)66-46)18-10-11-23-56/h2-9,12-17,19-22,28,31,39-46,58,67-68H,10-11,18,23-27,29-30,56H2,1H3,(H,59,73)(H,60,70)(H,61,74)(H,62,71)(H,63,75)(H,64,72)(H,66,69)(H,76,77)(H3,57,65,78)/t31-,39+,40+,41-,42+,43+,44-,45+,46-/m1/s1	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Salk Institute Curated by ChEMBL					Assay Description Binding affinity towards human somatostatin receptor type 4 using [125I]-[Leu8,DTrp22,Tyr25]SRIF-28 as radioligand.				J Med Chem 46: 5597-605 (2003) Article DOI: 10.1021/jm030245x BindingDB Entry DOI: 10.7270/Q2MK6C9X
					More data for this Ligand-Target Pair
Somatostatin receptor type 2 (Homo sapiens (Human))	BDBM50136790 ((4R,7S,10R,13S,16S,19S,22R,25S)-13-(4-Amino-butyl)...) 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](Cc2ccccc2)NC(=O)[C@@H](CSSC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(O)=O)NC(N)=O Show InChI InChI=1S/C55H67N11O12S2/c1-31(67)46-53(75)63-42(26-34-19-21-36(68)22-20-34)50(72)64-45(54(76)77)30-80-79-29-44(65-55(57)78)52(74)61-41(25-33-14-6-3-7-15-33)48(70)60-40(24-32-12-4-2-5-13-32)49(71)62-43(27-35-28-58-38-17-9-8-16-37(35)38)51(73)59-39(47(69)66-46)18-10-11-23-56/h2-9,12-17,19-22,28,31,39-46,58,67-68H,10-11,18,23-27,29-30,56H2,1H3,(H,59,73)(H,60,70)(H,61,74)(H,62,71)(H,63,75)(H,64,72)(H,66,69)(H,76,77)(H3,57,65,78)/t31-,39+,40+,41-,42+,43+,44-,45+,46-/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	52	n/a	n/a	n/a	n/a	n/a	n/a
Salk Institute Curated by ChEMBL					Assay Description Binding affinity towards human somatostatin receptor type 2 using [125I]-[Leu8,DTrp22,Tyr25]SRIF-28 as radioligand.				J Med Chem 46: 5597-605 (2003) Article DOI: 10.1021/jm030245x BindingDB Entry DOI: 10.7270/Q2MK6C9X
					More data for this Ligand-Target Pair