BDBM50192054 Ac-Phe-[Orn-Pro-cha-Trp-1Ni]::CHEMBL374542

SMILES: CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCNC(=O)[C@H](Cc2cccc3ccccc23)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC2CCCCC2)NC(=O)[C@@H]2CCCN2C1=O

InChI Key: InChIKey=PKOZYDKNIUFQDZ-QOPRFGGMSA-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 = 50192054   

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))	BDBM50192054 (Ac-Phe-[Orn-Pro-cha-Trp-1Ni] | CHEMBL374542) Show SMILES CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCNC(=O)[C@H](Cc2cccc3ccccc23)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC2CCCCC2)NC(=O)[C@@H]2CCCN2C1=O Show InChI InChI=1S/C54H64N8O7/c1-34(63)57-44(29-35-15-4-2-5-16-35)50(65)58-43-25-13-27-55-49(64)46(31-38-21-12-20-37-19-8-9-22-40(37)38)59-52(67)47(32-39-33-56-42-24-11-10-23-41(39)42)60-51(66)45(30-36-17-6-3-7-18-36)61-53(68)48-26-14-28-62(48)54(43)69/h2,4-5,8-12,15-16,19-24,33,36,43-48,56H,3,6-7,13-14,17-18,25-32H2,1H3,(H,55,64)(H,57,63)(H,58,65)(H,59,67)(H,60,66)(H,61,68)/t43-,44-,45+,46-,47-,48-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	51	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