BDBM50192059 Ac-Ala-[Orn-Pro-cha-Trp-Eag]::CHEMBL214024

SMILES: CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCNC(=O)[C@H](CC#N)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC2CCCCC2)NC(=O)[C@@H]2CCCN2C1=O

InChI Key: InChIKey=IKAZQLOOWZWUHF-WYLITWLFSA-N

Data: 1 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 1 hit for monomerid = 50192059   

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
C5a anaphylatoxin chemotactic receptor (C5aR) (Homo sapiens (Human))	BDBM50192059 (Ac-Ala-[Orn-Pro-cha-Trp-Eag] | CHEMBL214024) Show SMILES CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCNC(=O)[C@H](CC#N)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC2CCCCC2)NC(=O)[C@@H]2CCCN2C1=O Show InChI InChI=1S/C45H57N9O7/c1-28(55)49-36(24-29-12-4-2-5-13-29)41(57)51-35-18-10-22-47-40(56)34(20-21-46)50-43(59)38(26-31-27-48-33-17-9-8-16-32(31)33)52-42(58)37(25-30-14-6-3-7-15-30)53-44(60)39-19-11-23-54(39)45(35)61/h2,4-5,8-9,12-13,16-17,27,30,34-39,48H,3,6-7,10-11,14-15,18-20,22-26H2,1H3,(H,47,56)(H,49,55)(H,50,59)(H,51,57)(H,52,58)(H,53,60)/t34-,35-,36-,37+,38-,39-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
Jerini AG Curated by ChEMBL					Assay Description Antagonist activity at human C5aR in CD88 transfected RBL cells assessed as inhibition of C5a-induced glucosaminidase release				Bioorg Med Chem Lett 16: 5088-92 (2006) Article DOI: 10.1016/j.bmcl.2006.07.036 BindingDB Entry DOI: 10.7270/Q2RX9BP8
					More data for this Ligand-Target Pair