BDBM50370057 CHEMBL1794039

SMILES: C[C@H](O)[C@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)C(Cc2cccnc2)NC(=O)[C@H](CSSC[C@@H](NC1=O)C(=O)NC(Cc1ccc2ccccc2c1)C(N)=O)NC(=O)C(N)Cc1ccc(Cl)cc1

InChI Key: InChIKey=YJWANTNZRKLFSZ-HVROTQELSA-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 = 50370057   

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 2 (Homo sapiens (Human))	BDBM50370057 (CHEMBL1794039) Show SMILES C[C@H](O)[C@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)C(Cc2cccnc2)NC(=O)[C@H](CSSC[C@@H](NC1=O)C(=O)NC(Cc1ccc2ccccc2c1)C(N)=O)NC(=O)C(N)Cc1ccc(Cl)cc1 Show InChI InChI=1S/C59H71ClN12O9S2/c1-34(73)51-57(79)69-48(54(76)66-45(52(63)74)27-36-17-20-38-12-4-5-13-39(38)25-36)33-83-82-32-47(68-53(75)43(62)26-35-18-21-41(60)22-19-35)55(77)67-46(28-37-11-10-24-64-30-37)58(80)72(3)50(29-40-31-65-44-15-7-6-14-42(40)44)59(81)71(2)49(56(78)70-51)16-8-9-23-61/h4-7,10-15,17-22,24-25,30-31,34,43,45-51,65,73H,8-9,16,23,26-29,32-33,61-62H2,1-3H3,(H2,63,74)(H,66,76)(H,67,77)(H,68,75)(H,69,79)(H,70,78)/t34-,43?,45?,46?,47-,48+,49-,50+,51+/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	9.33	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tulane University Health Sciences Center Curated by ChEMBL					Assay Description Ability to displace [125 I]labelled Tyr11-somatostatin from human hsst-2 receptor expressed on CHO cells				J Med Chem 44: 1305-11 (2001) BindingDB Entry DOI: 10.7270/Q2Z038VZ
					More data for this Ligand-Target Pair
Somatostatin receptor type 5 (Homo sapiens (Human))	BDBM50370057 (CHEMBL1794039) Show SMILES C[C@H](O)[C@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)C(Cc2cccnc2)NC(=O)[C@H](CSSC[C@@H](NC1=O)C(=O)NC(Cc1ccc2ccccc2c1)C(N)=O)NC(=O)C(N)Cc1ccc(Cl)cc1 Show InChI InChI=1S/C59H71ClN12O9S2/c1-34(73)51-57(79)69-48(54(76)66-45(52(63)74)27-36-17-20-38-12-4-5-13-39(38)25-36)33-83-82-32-47(68-53(75)43(62)26-35-18-21-41(60)22-19-35)55(77)67-46(28-37-11-10-24-64-30-37)58(80)72(3)50(29-40-31-65-44-15-7-6-14-42(40)44)59(81)71(2)49(56(78)70-51)16-8-9-23-61/h4-7,10-15,17-22,24-25,30-31,34,43,45-51,65,73H,8-9,16,23,26-29,32-33,61-62H2,1-3H3,(H2,63,74)(H,66,76)(H,67,77)(H,68,75)(H,69,79)(H,70,78)/t34-,43?,45?,46?,47-,48+,49-,50+,51+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	112	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tulane University Health Sciences Center Curated by ChEMBL					Assay Description Ability to displace [125 I]labelled Tyr11-somatostatin from human hsst-5 receptor expressed on CHO cells				J Med Chem 44: 1305-11 (2001) BindingDB Entry DOI: 10.7270/Q2Z038VZ
					More data for this Ligand-Target Pair
Somatostatin receptor type 3 (Homo sapiens (Human))	BDBM50370057 (CHEMBL1794039) Show SMILES C[C@H](O)[C@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)C(Cc2cccnc2)NC(=O)[C@H](CSSC[C@@H](NC1=O)C(=O)NC(Cc1ccc2ccccc2c1)C(N)=O)NC(=O)C(N)Cc1ccc(Cl)cc1 Show InChI InChI=1S/C59H71ClN12O9S2/c1-34(73)51-57(79)69-48(54(76)66-45(52(63)74)27-36-17-20-38-12-4-5-13-39(38)25-36)33-83-82-32-47(68-53(75)43(62)26-35-18-21-41(60)22-19-35)55(77)67-46(28-37-11-10-24-64-30-37)58(80)72(3)50(29-40-31-65-44-15-7-6-14-42(40)44)59(81)71(2)49(56(78)70-51)16-8-9-23-61/h4-7,10-15,17-22,24-25,30-31,34,43,45-51,65,73H,8-9,16,23,26-29,32-33,61-62H2,1-3H3,(H2,63,74)(H,66,76)(H,67,77)(H,68,75)(H,69,79)(H,70,78)/t34-,43?,45?,46?,47-,48+,49-,50+,51+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	140	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tulane University Health Sciences Center Curated by ChEMBL					Assay Description Ability to displace [125 I]labelled Tyr11-somatostatin from human hsst-3 receptor expressed on CHO cells				J Med Chem 44: 1305-11 (2001) BindingDB Entry DOI: 10.7270/Q2Z038VZ
					More data for this Ligand-Target Pair
Somatostatin receptor type 1 (Homo sapiens (Human))	BDBM50370057 (CHEMBL1794039) Show SMILES C[C@H](O)[C@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)C(Cc2cccnc2)NC(=O)[C@H](CSSC[C@@H](NC1=O)C(=O)NC(Cc1ccc2ccccc2c1)C(N)=O)NC(=O)C(N)Cc1ccc(Cl)cc1 Show InChI InChI=1S/C59H71ClN12O9S2/c1-34(73)51-57(79)69-48(54(76)66-45(52(63)74)27-36-17-20-38-12-4-5-13-39(38)25-36)33-83-82-32-47(68-53(75)43(62)26-35-18-21-41(60)22-19-35)55(77)67-46(28-37-11-10-24-64-30-37)58(80)72(3)50(29-40-31-65-44-15-7-6-14-42(40)44)59(81)71(2)49(56(78)70-51)16-8-9-23-61/h4-7,10-15,17-22,24-25,30-31,34,43,45-51,65,73H,8-9,16,23,26-29,32-33,61-62H2,1-3H3,(H2,63,74)(H,66,76)(H,67,77)(H,68,75)(H,69,79)(H,70,78)/t34-,43?,45?,46?,47-,48+,49-,50+,51+/m0/s1	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tulane University Health Sciences Center Curated by ChEMBL					Assay Description Ability to displace [125 I]labelled Tyr11-somatostatin from human hsst-1 receptor expressed on CHO cells				J Med Chem 44: 1305-11 (2001) BindingDB Entry DOI: 10.7270/Q2Z038VZ
					More data for this Ligand-Target Pair
Somatostatin receptor type 4 (Homo sapiens (Human))	BDBM50370057 (CHEMBL1794039) Show SMILES C[C@H](O)[C@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)C(Cc2cccnc2)NC(=O)[C@H](CSSC[C@@H](NC1=O)C(=O)NC(Cc1ccc2ccccc2c1)C(N)=O)NC(=O)C(N)Cc1ccc(Cl)cc1 Show InChI InChI=1S/C59H71ClN12O9S2/c1-34(73)51-57(79)69-48(54(76)66-45(52(63)74)27-36-17-20-38-12-4-5-13-39(38)25-36)33-83-82-32-47(68-53(75)43(62)26-35-18-21-41(60)22-19-35)55(77)67-46(28-37-11-10-24-64-30-37)58(80)72(3)50(29-40-31-65-44-15-7-6-14-42(40)44)59(81)71(2)49(56(78)70-51)16-8-9-23-61/h4-7,10-15,17-22,24-25,30-31,34,43,45-51,65,73H,8-9,16,23,26-29,32-33,61-62H2,1-3H3,(H2,63,74)(H,66,76)(H,67,77)(H,68,75)(H,69,79)(H,70,78)/t34-,43?,45?,46?,47-,48+,49-,50+,51+/m0/s1	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tulane University Health Sciences Center Curated by ChEMBL					Assay Description Ability to displace [125 I]labelled Tyr11-somatostatin from human hsst-4 receptor expressed on CHO cells				J Med Chem 44: 1305-11 (2001) BindingDB Entry DOI: 10.7270/Q2Z038VZ
					More data for this Ligand-Target Pair