null

SMILES: NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H]1CCCN1C(=O)[C@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccccc2)C(=O)NCC(=O)N[C@H](CC(N)=O)C(=O)N1

InChI Key: InChIKey=XZDZYGSNLJCRQP-YZNZALTISA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50145125   

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
Vasopressin V1b receptor (Homo sapiens (Human))	BDBM50145125 ((2S)-2-{[(2R)-1-{[(4S,7R,13R,16S)-13-benzyl-7-(car...) Show SMILES NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H]1CCCN1C(=O)[C@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccccc2)C(=O)NCC(=O)N[C@H](CC(N)=O)C(=O)N1 Show InChI InChI=1S/C43H59N13O11S2/c44-33(58)20-30-40(65)55-31(42(67)56-16-5-9-32(56)41(66)53-27(8-4-15-48-43(46)47)37(62)49-21-34(45)59)23-69-68-17-14-35(60)51-29(19-25-10-12-26(57)13-11-25)39(64)54-28(18-24-6-2-1-3-7-24)38(63)50-22-36(61)52-30/h1-3,6-7,10-13,27-32,57H,4-5,8-9,14-23H2,(H2,44,58)(H2,45,59)(H,49,62)(H,50,63)(H,51,60)(H,52,61)(H,53,66)(H,54,64)(H,55,65)(H4,46,47,48)/t27-,28+,29-,30+,31+,32+/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	22.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical College of Ohio Curated by ChEMBL					Assay Description Binding affinity against human vasopressin V1b receptor was determined by using plasma membranes from CHO cells stably transfected with VP/OT recepto...				J Med Chem 47: 2375-88 (2004) Article DOI: 10.1021/jm030611c BindingDB Entry DOI: 10.7270/Q2GF0V8C
					More data for this Ligand-Target Pair
Vasopressin V1a receptor (Homo sapiens (Human))	BDBM50145125 ((2S)-2-{[(2R)-1-{[(4S,7R,13R,16S)-13-benzyl-7-(car...) Show SMILES NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H]1CCCN1C(=O)[C@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccccc2)C(=O)NCC(=O)N[C@H](CC(N)=O)C(=O)N1 Show InChI InChI=1S/C43H59N13O11S2/c44-33(58)20-30-40(65)55-31(42(67)56-16-5-9-32(56)41(66)53-27(8-4-15-48-43(46)47)37(62)49-21-34(45)59)23-69-68-17-14-35(60)51-29(19-25-10-12-26(57)13-11-25)39(64)54-28(18-24-6-2-1-3-7-24)38(63)50-22-36(61)52-30/h1-3,6-7,10-13,27-32,57H,4-5,8-9,14-23H2,(H2,44,58)(H2,45,59)(H,49,62)(H,50,63)(H,51,60)(H,52,61)(H,53,66)(H,54,64)(H,55,65)(H4,46,47,48)/t27-,28+,29-,30+,31+,32+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	276	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical College of Ohio Curated by ChEMBL					Assay Description Binding affinity against human vasopressin V1a receptor was determined by using plasma membranes from CHO cells stably transfected with VP/OT recepto...				J Med Chem 47: 2375-88 (2004) Article DOI: 10.1021/jm030611c BindingDB Entry DOI: 10.7270/Q2GF0V8C
					More data for this Ligand-Target Pair
Vasopressin V2 receptor (Homo sapiens (Human))	BDBM50145125 ((2S)-2-{[(2R)-1-{[(4S,7R,13R,16S)-13-benzyl-7-(car...) Show SMILES NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H]1CCCN1C(=O)[C@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccccc2)C(=O)NCC(=O)N[C@H](CC(N)=O)C(=O)N1 Show InChI InChI=1S/C43H59N13O11S2/c44-33(58)20-30-40(65)55-31(42(67)56-16-5-9-32(56)41(66)53-27(8-4-15-48-43(46)47)37(62)49-21-34(45)59)23-69-68-17-14-35(60)51-29(19-25-10-12-26(57)13-11-25)39(64)54-28(18-24-6-2-1-3-7-24)38(63)50-22-36(61)52-30/h1-3,6-7,10-13,27-32,57H,4-5,8-9,14-23H2,(H2,44,58)(H2,45,59)(H,49,62)(H,50,63)(H,51,60)(H,52,61)(H,53,66)(H,54,64)(H,55,65)(H4,46,47,48)/t27-,28+,29-,30+,31+,32+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	554	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical College of Ohio Curated by ChEMBL					Assay Description Binding affinity against human vasopressin V2 receptor was determined by using plasma membranes from CHO cells stably transfected with VP/OT receptor...				J Med Chem 47: 2375-88 (2004) Article DOI: 10.1021/jm030611c BindingDB Entry DOI: 10.7270/Q2GF0V8C
					More data for this Ligand-Target Pair
Oxytocin receptor (Homo sapiens (Human))	BDBM50145125 ((2S)-2-{[(2R)-1-{[(4S,7R,13R,16S)-13-benzyl-7-(car...) Show SMILES NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H]1CCCN1C(=O)[C@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccccc2)C(=O)NCC(=O)N[C@H](CC(N)=O)C(=O)N1 Show InChI InChI=1S/C43H59N13O11S2/c44-33(58)20-30-40(65)55-31(42(67)56-16-5-9-32(56)41(66)53-27(8-4-15-48-43(46)47)37(62)49-21-34(45)59)23-69-68-17-14-35(60)51-29(19-25-10-12-26(57)13-11-25)39(64)54-28(18-24-6-2-1-3-7-24)38(63)50-22-36(61)52-30/h1-3,6-7,10-13,27-32,57H,4-5,8-9,14-23H2,(H2,44,58)(H2,45,59)(H,49,62)(H,50,63)(H,51,60)(H,52,61)(H,53,66)(H,54,64)(H,55,65)(H4,46,47,48)/t27-,28+,29-,30+,31+,32+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	556	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical College of Ohio Curated by ChEMBL					Assay Description Binding affinity against human oxytocin receptor was determined by using plasma membranes from CHO cells stably transfected with VP/OT receptors				J Med Chem 47: 2375-88 (2004) Article DOI: 10.1021/jm030611c BindingDB Entry DOI: 10.7270/Q2GF0V8C
					More data for this Ligand-Target Pair