BDBM50075820 CHEMBL405165::Mpa-D-Trp-lle-Gln-Asn-Cys-Sar-Arg-Gly-NH2

SMILES: CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](CCC(N)=O)NC1=O)C(=O)N(C)CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O

InChI Key: InChIKey=GSRQJRBOLWRNPI-JUNWNGMJSA-N

Data: 3 Kd

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 3 hits for monomerid = 50075820   

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
Oxytocin receptor (Homo sapiens (Human))	BDBM50075820 (CHEMBL405165 | Mpa-D-Trp-lle-Gln-Asn-Cys-Sar-Arg-G...) Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](CCC(N)=O)NC1=O)C(=O)N(C)CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O Show InChI InChI=1S/C43H65N15O11S2/c1-4-22(2)36-41(68)54-27(11-12-31(44)59)38(65)55-29(17-32(45)60)39(66)56-30(42(69)58(3)20-35(63)52-26(10-7-14-49-43(47)48)37(64)51-19-33(46)61)21-71-70-15-13-34(62)53-28(40(67)57-36)16-23-18-50-25-9-6-5-8-24(23)25/h5-6,8-9,18,22,26-30,36,50H,4,7,10-17,19-21H2,1-3H3,(H2,44,59)(H2,45,60)(H2,46,61)(H,51,64)(H,52,63)(H,53,62)(H,54,68)(H,55,65)(H,56,66)(H,57,67)(H4,47,48,49)/t22-,26-,27+,28-,29-,30-,36-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	38	n/a	n/a	n/a	n/a	n/a
Albert Szent-Gy£rgyi Medical University Curated by ChEMBL					Assay Description Compound was evaluated for its dissociation constant (Kd) to guinea pig myometrial Oxytocin receptor				Bioorg Med Chem Lett 9: 667-72 (1999) BindingDB Entry DOI: 10.7270/Q2QC040K
					More data for this Ligand-Target Pair
Vasopressin V1 receptor (RAT)	BDBM50075820 (CHEMBL405165 | Mpa-D-Trp-lle-Gln-Asn-Cys-Sar-Arg-G...) Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](CCC(N)=O)NC1=O)C(=O)N(C)CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O Show InChI InChI=1S/C43H65N15O11S2/c1-4-22(2)36-41(68)54-27(11-12-31(44)59)38(65)55-29(17-32(45)60)39(66)56-30(42(69)58(3)20-35(63)52-26(10-7-14-49-43(47)48)37(64)51-19-33(46)61)21-71-70-15-13-34(62)53-28(40(67)57-36)16-23-18-50-25-9-6-5-8-24(23)25/h5-6,8-9,18,22,26-30,36,50H,4,7,10-17,19-21H2,1-3H3,(H2,44,59)(H2,45,60)(H2,46,61)(H,51,64)(H,52,63)(H,53,62)(H,54,68)(H,55,65)(H,56,66)(H,57,67)(H4,47,48,49)/t22-,26-,27+,28-,29-,30-,36-/m0/s1	MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	888	n/a	n/a	n/a	n/a	n/a
Albert Szent-Gy£rgyi Medical University Curated by ChEMBL					Assay Description Compound was evaluated for its dissociation constant (Kd) to rat liver Vasopressin V1 receptor				Bioorg Med Chem Lett 9: 667-72 (1999) BindingDB Entry DOI: 10.7270/Q2QC040K
					More data for this Ligand-Target Pair
Vasopressin V2 Receptor (Rattus norvegicus (Rat))	BDBM50075820 (CHEMBL405165 | Mpa-D-Trp-lle-Gln-Asn-Cys-Sar-Arg-G...) Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](CCC(N)=O)NC1=O)C(=O)N(C)CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O Show InChI InChI=1S/C43H65N15O11S2/c1-4-22(2)36-41(68)54-27(11-12-31(44)59)38(65)55-29(17-32(45)60)39(66)56-30(42(69)58(3)20-35(63)52-26(10-7-14-49-43(47)48)37(64)51-19-33(46)61)21-71-70-15-13-34(62)53-28(40(67)57-36)16-23-18-50-25-9-6-5-8-24(23)25/h5-6,8-9,18,22,26-30,36,50H,4,7,10-17,19-21H2,1-3H3,(H2,44,59)(H2,45,60)(H2,46,61)(H,51,64)(H,52,63)(H,53,62)(H,54,68)(H,55,65)(H,56,66)(H,57,67)(H4,47,48,49)/t22-,26-,27+,28-,29-,30-,36-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	4.96E+3	n/a	n/a	n/a	n/a	n/a
Albert Szent-Gy£rgyi Medical University Curated by ChEMBL					Assay Description Compound was evaluated for its dissociation constant (Kd) to rat kidney Vasopressin V2 receptor				Bioorg Med Chem Lett 9: 667-72 (1999) BindingDB Entry DOI: 10.7270/Q2QC040K
					More data for this Ligand-Target Pair