BDBM50175587 (S)-3-Amino-N-{(S)-1-[3-[(S)-2-[2-((S)-(S)-1-carboxy-2-phenyl-ethylcarbamoyl)-pyrrolidin-1-yl]-1-(3H-imidazol-4-ylmethyl)-2-oxo-ethylcarbamoyl]-5-(4-hydroxy-benzyl)-phenylcarbamoyl]-4-guanidino-butyl}-succinamic acid::CHEMBL194864

SMILES: N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)Nc1cc(Cc2ccc(O)cc2)cc(c1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O

InChI Key: InChIKey=KONOAYSEVHPZMY-XYPUQJIVSA-N

Data: 2 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 2 hits for monomerid = 50175587   

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
Angiotensin II receptor (Homo sapiens (Human))	BDBM50175587 ((S)-3-Amino-N-{(S)-1-[3-[(S)-2-[2-((S)-(S)-1-carbo...) Show SMILES N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)Nc1cc(Cc2ccc(O)cc2)cc(c1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C44H53N11O10/c45-32(22-37(57)58)39(60)52-33(8-4-14-49-44(46)47)40(61)51-29-18-27(16-26-10-12-31(56)13-11-26)17-28(20-29)38(59)53-34(21-30-23-48-24-50-30)42(63)55-15-5-9-36(55)41(62)54-35(43(64)65)19-25-6-2-1-3-7-25/h1-3,6-7,10-13,17-18,20,23-24,32-36,56H,4-5,8-9,14-16,19,21-22,45H2,(H,48,50)(H,51,61)(H,52,60)(H,53,59)(H,54,62)(H,57,58)(H,64,65)(H4,46,47,49)/t32-,33-,34-,35-,36-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	41.3	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
Uppsala University Curated by ChEMBL					Assay Description Binding affinity for angiotensin II receptor, type 2 in pig uterus myometrium using [125I]-Ang II as radioligand, in pH 7.4 Tris-HCl buffer for 1.5 h...				J Med Chem 48: 6620-31 (2005) Article DOI: 10.1021/jm050280z BindingDB Entry DOI: 10.7270/Q2HX1DG6
					More data for this Ligand-Target Pair
Angiotensin II AT1B (RAT)	BDBM50175587 ((S)-3-Amino-N-{(S)-1-[3-[(S)-2-[2-((S)-(S)-1-carbo...) Show SMILES N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)Nc1cc(Cc2ccc(O)cc2)cc(c1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C44H53N11O10/c45-32(22-37(57)58)39(60)52-33(8-4-14-49-44(46)47)40(61)51-29-18-27(16-26-10-12-31(56)13-11-26)17-28(20-29)38(59)53-34(21-30-23-48-24-50-30)42(63)55-15-5-9-36(55)41(62)54-35(43(64)65)19-25-6-2-1-3-7-25/h1-3,6-7,10-13,17-18,20,23-24,32-36,56H,4-5,8-9,14-16,19,21-22,45H2,(H,48,50)(H,51,61)(H,52,60)(H,53,59)(H,54,62)(H,57,58)(H,64,65)(H4,46,47,49)/t32-,33-,34-,35-,36-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
Uppsala University Curated by ChEMBL					Assay Description Binding affinity for angiotensin II receptor, type 1 in rat liver membrane using [125I]-Ang II as radioligand, in pH 7.4 Tris-HCl buffer for 2 hr at ...				J Med Chem 48: 6620-31 (2005) Article DOI: 10.1021/jm050280z BindingDB Entry DOI: 10.7270/Q2HX1DG6
					More data for this Ligand-Target Pair