BDBM50370052 CHEMBL1794046

SMILES: CNC(=O)C(NC(=O)[C@H]1CSSC[C@H](N(C)C(=O)C(N)Cc2ccc(Cl)cc2)C(=O)NC(Cc2cccnc2)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]([C@H](C)O)C(=O)N1)C(c1ccccc1)c1ccccc1

InChI Key: InChIKey=YAYWDFOWCWBWEH-YXYNMIDZSA-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 = 50370052   

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))	BDBM50370052 (CHEMBL1794046) Show SMILES CNC(=O)C(NC(=O)[C@H]1CSSC[C@H](N(C)C(=O)C(N)Cc2ccc(Cl)cc2)C(=O)NC(Cc2cccnc2)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]([C@H](C)O)C(=O)N1)C(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C61H73ClN12O9S2/c1-36(75)52-60(82)71-49(57(79)73-53(59(81)65-2)51(39-16-6-4-7-17-39)40-18-8-5-9-19-40)34-84-85-35-50(74(3)61(83)44(64)29-37-23-25-42(62)26-24-37)58(80)70-47(30-38-15-14-28-66-32-38)55(77)69-48(31-41-33-67-45-21-11-10-20-43(41)45)56(78)68-46(54(76)72-52)22-12-13-27-63/h4-11,14-21,23-26,28,32-33,36,44,46-53,67,75H,12-13,22,27,29-31,34-35,63-64H2,1-3H3,(H,65,81)(H,68,78)(H,69,77)(H,70,80)(H,71,82)(H,72,76)(H,73,79)/t36-,44?,46-,47?,48+,49+,50-,52+,53?/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	117	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 3 (Homo sapiens (Human))	BDBM50370052 (CHEMBL1794046) Show SMILES CNC(=O)C(NC(=O)[C@H]1CSSC[C@H](N(C)C(=O)C(N)Cc2ccc(Cl)cc2)C(=O)NC(Cc2cccnc2)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]([C@H](C)O)C(=O)N1)C(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C61H73ClN12O9S2/c1-36(75)52-60(82)71-49(57(79)73-53(59(81)65-2)51(39-16-6-4-7-17-39)40-18-8-5-9-19-40)34-84-85-35-50(74(3)61(83)44(64)29-37-23-25-42(62)26-24-37)58(80)70-47(30-38-15-14-28-66-32-38)55(77)69-48(31-41-33-67-45-21-11-10-20-43(41)45)56(78)68-46(54(76)72-52)22-12-13-27-63/h4-11,14-21,23-26,28,32-33,36,44,46-53,67,75H,12-13,22,27,29-31,34-35,63-64H2,1-3H3,(H,65,81)(H,68,78)(H,69,77)(H,70,80)(H,71,82)(H,72,76)(H,73,79)/t36-,44?,46-,47?,48+,49+,50-,52+,53?/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	584	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 5 (Homo sapiens (Human))	BDBM50370052 (CHEMBL1794046) Show SMILES CNC(=O)C(NC(=O)[C@H]1CSSC[C@H](N(C)C(=O)C(N)Cc2ccc(Cl)cc2)C(=O)NC(Cc2cccnc2)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]([C@H](C)O)C(=O)N1)C(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C61H73ClN12O9S2/c1-36(75)52-60(82)71-49(57(79)73-53(59(81)65-2)51(39-16-6-4-7-17-39)40-18-8-5-9-19-40)34-84-85-35-50(74(3)61(83)44(64)29-37-23-25-42(62)26-24-37)58(80)70-47(30-38-15-14-28-66-32-38)55(77)69-48(31-41-33-67-45-21-11-10-20-43(41)45)56(78)68-46(54(76)72-52)22-12-13-27-63/h4-11,14-21,23-26,28,32-33,36,44,46-53,67,75H,12-13,22,27,29-31,34-35,63-64H2,1-3H3,(H,65,81)(H,68,78)(H,69,77)(H,70,80)(H,71,82)(H,72,76)(H,73,79)/t36-,44?,46-,47?,48+,49+,50-,52+,53?/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	766	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 1 (Homo sapiens (Human))	BDBM50370052 (CHEMBL1794046) Show SMILES CNC(=O)C(NC(=O)[C@H]1CSSC[C@H](N(C)C(=O)C(N)Cc2ccc(Cl)cc2)C(=O)NC(Cc2cccnc2)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]([C@H](C)O)C(=O)N1)C(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C61H73ClN12O9S2/c1-36(75)52-60(82)71-49(57(79)73-53(59(81)65-2)51(39-16-6-4-7-17-39)40-18-8-5-9-19-40)34-84-85-35-50(74(3)61(83)44(64)29-37-23-25-42(62)26-24-37)58(80)70-47(30-38-15-14-28-66-32-38)55(77)69-48(31-41-33-67-45-21-11-10-20-43(41)45)56(78)68-46(54(76)72-52)22-12-13-27-63/h4-11,14-21,23-26,28,32-33,36,44,46-53,67,75H,12-13,22,27,29-31,34-35,63-64H2,1-3H3,(H,65,81)(H,68,78)(H,69,77)(H,70,80)(H,71,82)(H,72,76)(H,73,79)/t36-,44?,46-,47?,48+,49+,50-,52+,53?/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))	BDBM50370052 (CHEMBL1794046) Show SMILES CNC(=O)C(NC(=O)[C@H]1CSSC[C@H](N(C)C(=O)C(N)Cc2ccc(Cl)cc2)C(=O)NC(Cc2cccnc2)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]([C@H](C)O)C(=O)N1)C(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C61H73ClN12O9S2/c1-36(75)52-60(82)71-49(57(79)73-53(59(81)65-2)51(39-16-6-4-7-17-39)40-18-8-5-9-19-40)34-84-85-35-50(74(3)61(83)44(64)29-37-23-25-42(62)26-24-37)58(80)70-47(30-38-15-14-28-66-32-38)55(77)69-48(31-41-33-67-45-21-11-10-20-43(41)45)56(78)68-46(54(76)72-52)22-12-13-27-63/h4-11,14-21,23-26,28,32-33,36,44,46-53,67,75H,12-13,22,27,29-31,34-35,63-64H2,1-3H3,(H,65,81)(H,68,78)(H,69,77)(H,70,80)(H,71,82)(H,72,76)(H,73,79)/t36-,44?,46-,47?,48+,49+,50-,52+,53?/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