BDBM50192044 Ac-Phe-Orn-Pro-hle-Bta-Phe-NH2::CHEMBL262177

SMILES: CC(C)CC[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN)NC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@H](Cc1csc2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(N)=O

InChI Key: InChIKey=RPQNJFODSYIOJA-JDYMMFPTSA-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 = 50192044   

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))	BDBM50192044 (Ac-Phe-Orn-Pro-hle-Bta-Phe-NH2 | CHEMBL262177) Show SMILES CC(C)CC[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN)NC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@H](Cc1csc2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C48H62N8O7S/c1-30(2)22-23-36(44(59)55-40(28-34-29-64-42-21-11-10-18-35(34)42)46(61)54-38(43(50)58)26-32-14-6-4-7-15-32)52-47(62)41-20-13-25-56(41)48(63)37(19-12-24-49)53-45(60)39(51-31(3)57)27-33-16-8-5-9-17-33/h4-11,14-18,21,29-30,36-41H,12-13,19-20,22-28,49H2,1-3H3,(H2,50,58)(H,51,57)(H,52,62)(H,53,60)(H,54,61)(H,55,59)/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	27	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