BDBM50243523 2-(4-{[(2-{[(1R)-1-{[(4R,7S,10S,13R,16S,19S)-10-(4-aminobutyl)-4-{[(1S)-1-carbamoyl-2-(naphthalen-2-yl)ethyl]carbamoyl}-16-{[4-(carbamoylamino)phenyl]methyl}-7-[(1R)-1-hydroxyethyl]-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-19-yl]carbamoyl}-2-(4-chlorophenyl)ethyl]carbamoyl}ethyl)carbamoyl]methyl}-7,10-bis(carboxymethyl)-1,4,7,10-tetraazacyclododecan-1-yl)acetic acid::CHEMBL502077

SMILES: C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(NC(N)=O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CCNC(=O)CN1CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC1

InChI Key: InChIKey=AQPTXVNPBKVPKV-XQNVDWLZSA-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 = 50243523   

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 5 (Homo sapiens (Human))	BDBM50243523 (2-(4-{[(2-{[(1R)-1-{[(4R,7S,10S,13R,16S,19S)-10-(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](Cc2ccc(NC(N)=O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CCNC(=O)CN1CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC1 |r| Show InChI InChI=1S/C78H101ClN18O18S2/c1-46(98)69-77(114)92-63(75(112)88-58(70(81)107)37-49-13-18-50-8-2-3-9-51(50)34-49)45-117-116-44-62(76(113)89-60(36-48-16-21-54(22-17-48)85-78(82)115)73(110)90-61(38-52-39-84-56-11-5-4-10-55(52)56)74(111)87-57(71(108)93-69)12-6-7-24-80)91-72(109)59(35-47-14-19-53(79)20-15-47)86-64(99)23-25-83-65(100)40-94-26-28-95(41-66(101)102)30-32-97(43-68(105)106)33-31-96(29-27-94)42-67(103)104/h2-5,8-11,13-22,34,39,46,57-63,69,84,98H,6-7,12,23-33,35-38,40-45,80H2,1H3,(H2,81,107)(H,83,100)(H,86,99)(H,87,111)(H,88,112)(H,89,113)(H,90,110)(H,91,109)(H,92,114)(H,93,108)(H,101,102)(H,103,104)(H,105,106)(H3,82,85,115)/t46-,57+,58+,59-,60+,61-,62-,63+,69+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Berne Curated by ChEMBL					Assay Description Displacement of [125I][LTT]SRIF28 from human cloned sst5 receptor by autoradiography				J Med Chem 51: 4030-7 (2008) Article DOI: 10.1021/jm701618q BindingDB Entry DOI: 10.7270/Q22J6CSW
					More data for this Ligand-Target Pair
Somatostatin receptor type 1 (Homo sapiens (Human))	BDBM50243523 (2-(4-{[(2-{[(1R)-1-{[(4R,7S,10S,13R,16S,19S)-10-(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](Cc2ccc(NC(N)=O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CCNC(=O)CN1CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC1 |r| Show InChI InChI=1S/C78H101ClN18O18S2/c1-46(98)69-77(114)92-63(75(112)88-58(70(81)107)37-49-13-18-50-8-2-3-9-51(50)34-49)45-117-116-44-62(76(113)89-60(36-48-16-21-54(22-17-48)85-78(82)115)73(110)90-61(38-52-39-84-56-11-5-4-10-55(52)56)74(111)87-57(71(108)93-69)12-6-7-24-80)91-72(109)59(35-47-14-19-53(79)20-15-47)86-64(99)23-25-83-65(100)40-94-26-28-95(41-66(101)102)30-32-97(43-68(105)106)33-31-96(29-27-94)42-67(103)104/h2-5,8-11,13-22,34,39,46,57-63,69,84,98H,6-7,12,23-33,35-38,40-45,80H2,1H3,(H2,81,107)(H,83,100)(H,86,99)(H,87,111)(H,88,112)(H,89,113)(H,90,110)(H,91,109)(H,92,114)(H,93,108)(H,101,102)(H,103,104)(H,105,106)(H3,82,85,115)/t46-,57+,58+,59-,60+,61-,62-,63+,69+/m1/s1	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Berne Curated by ChEMBL					Assay Description Displacement of [125I][LTT]SRIF28 from human cloned sst1 receptor by autoradiography				J Med Chem 51: 4030-7 (2008) Article DOI: 10.1021/jm701618q BindingDB Entry DOI: 10.7270/Q22J6CSW
					More data for this Ligand-Target Pair
Somatostatin receptor type 4 (Homo sapiens (Human))	BDBM50243523 (2-(4-{[(2-{[(1R)-1-{[(4R,7S,10S,13R,16S,19S)-10-(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](Cc2ccc(NC(N)=O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CCNC(=O)CN1CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC1 |r| Show InChI InChI=1S/C78H101ClN18O18S2/c1-46(98)69-77(114)92-63(75(112)88-58(70(81)107)37-49-13-18-50-8-2-3-9-51(50)34-49)45-117-116-44-62(76(113)89-60(36-48-16-21-54(22-17-48)85-78(82)115)73(110)90-61(38-52-39-84-56-11-5-4-10-55(52)56)74(111)87-57(71(108)93-69)12-6-7-24-80)91-72(109)59(35-47-14-19-53(79)20-15-47)86-64(99)23-25-83-65(100)40-94-26-28-95(41-66(101)102)30-32-97(43-68(105)106)33-31-96(29-27-94)42-67(103)104/h2-5,8-11,13-22,34,39,46,57-63,69,84,98H,6-7,12,23-33,35-38,40-45,80H2,1H3,(H2,81,107)(H,83,100)(H,86,99)(H,87,111)(H,88,112)(H,89,113)(H,90,110)(H,91,109)(H,92,114)(H,93,108)(H,101,102)(H,103,104)(H,105,106)(H3,82,85,115)/t46-,57+,58+,59-,60+,61-,62-,63+,69+/m1/s1	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Berne Curated by ChEMBL					Assay Description Displacement of [125I][LTT]SRIF28 from human cloned sst4 receptor by autoradiography				J Med Chem 51: 4030-7 (2008) Article DOI: 10.1021/jm701618q BindingDB Entry DOI: 10.7270/Q22J6CSW
					More data for this Ligand-Target Pair
Somatostatin receptor type 3 (Homo sapiens (Human))	BDBM50243523 (2-(4-{[(2-{[(1R)-1-{[(4R,7S,10S,13R,16S,19S)-10-(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](Cc2ccc(NC(N)=O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CCNC(=O)CN1CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC1 |r| Show InChI InChI=1S/C78H101ClN18O18S2/c1-46(98)69-77(114)92-63(75(112)88-58(70(81)107)37-49-13-18-50-8-2-3-9-51(50)34-49)45-117-116-44-62(76(113)89-60(36-48-16-21-54(22-17-48)85-78(82)115)73(110)90-61(38-52-39-84-56-11-5-4-10-55(52)56)74(111)87-57(71(108)93-69)12-6-7-24-80)91-72(109)59(35-47-14-19-53(79)20-15-47)86-64(99)23-25-83-65(100)40-94-26-28-95(41-66(101)102)30-32-97(43-68(105)106)33-31-96(29-27-94)42-67(103)104/h2-5,8-11,13-22,34,39,46,57-63,69,84,98H,6-7,12,23-33,35-38,40-45,80H2,1H3,(H2,81,107)(H,83,100)(H,86,99)(H,87,111)(H,88,112)(H,89,113)(H,90,110)(H,91,109)(H,92,114)(H,93,108)(H,101,102)(H,103,104)(H,105,106)(H3,82,85,115)/t46-,57+,58+,59-,60+,61-,62-,63+,69+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	124	n/a	n/a	n/a	n/a	n/a	n/a
University of Berne Curated by ChEMBL					Assay Description Displacement of [125I][LTT]SRIF28 from human cloned sst3 receptor by autoradiography				J Med Chem 51: 4030-7 (2008) Article DOI: 10.1021/jm701618q BindingDB Entry DOI: 10.7270/Q22J6CSW
					More data for this Ligand-Target Pair
Somatostatin receptor type 2 (Homo sapiens (Human))	BDBM50243523 (2-(4-{[(2-{[(1R)-1-{[(4R,7S,10S,13R,16S,19S)-10-(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](Cc2ccc(NC(N)=O)cc2)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)CCNC(=O)CN1CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC1 |r| Show InChI InChI=1S/C78H101ClN18O18S2/c1-46(98)69-77(114)92-63(75(112)88-58(70(81)107)37-49-13-18-50-8-2-3-9-51(50)34-49)45-117-116-44-62(76(113)89-60(36-48-16-21-54(22-17-48)85-78(82)115)73(110)90-61(38-52-39-84-56-11-5-4-10-55(52)56)74(111)87-57(71(108)93-69)12-6-7-24-80)91-72(109)59(35-47-14-19-53(79)20-15-47)86-64(99)23-25-83-65(100)40-94-26-28-95(41-66(101)102)30-32-97(43-68(105)106)33-31-96(29-27-94)42-67(103)104/h2-5,8-11,13-22,34,39,46,57-63,69,84,98H,6-7,12,23-33,35-38,40-45,80H2,1H3,(H2,81,107)(H,83,100)(H,86,99)(H,87,111)(H,88,112)(H,89,113)(H,90,110)(H,91,109)(H,92,114)(H,93,108)(H,101,102)(H,103,104)(H,105,106)(H3,82,85,115)/t46-,57+,58+,59-,60+,61-,62-,63+,69+/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	46	n/a	n/a	n/a	n/a	n/a	n/a
University of Berne Curated by ChEMBL					Assay Description Displacement of [125I][LTT]SRIF28 from human cloned sst2 receptor by autoradiography				J Med Chem 51: 4030-7 (2008) Article DOI: 10.1021/jm701618q BindingDB Entry DOI: 10.7270/Q22J6CSW
					More data for this Ligand-Target Pair