BDBM50192042 Ac-Phe-Orn-Pro-cha-Trp-Nle-NH2::CHEMBL374120

SMILES: CCCC[C@@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](CC1CCCCC1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN)NC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(N)=O

InChI Key: InChIKey=RBRLFMSWWXGMNN-HQDDLRASSA-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 = 50192042   

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))	BDBM50192042 (Ac-Phe-Orn-Pro-cha-Trp-Nle-NH2 | CHEMBL374120) Show SMILES CCCC[C@@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](CC1CCCCC1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN)NC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(N)=O Show InChI InChI=1S/C47H67N9O7/c1-3-4-20-36(42(49)58)52-45(61)40(28-33-29-50-35-21-12-11-19-34(33)35)54-44(60)39(27-32-17-9-6-10-18-32)55-46(62)41-23-14-25-56(41)47(63)37(22-13-24-48)53-43(59)38(51-30(2)57)26-31-15-7-5-8-16-31/h5,7-8,11-12,15-16,19,21,29,32,36-41,50H,3-4,6,9-10,13-14,17-18,20,22-28,48H2,1-2H3,(H2,49,58)(H,51,57)(H,52,61)(H,53,59)(H,54,60)(H,55,62)/t36-,37+,38+,39-,40-,41+/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	463	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