BDBM50376790 CHEMBL257175

SMILES: CCc1cccc(CC)c1-c1cc(OC)c2C(CCCc2n1)N[C@@H]1CCCc2ccccc12

InChI Key: InChIKey=RPWRCPNRVFIHNA-IKOFQBKESA-N

Data: 2 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 2 hits for monomerid = 50376790   

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))	BDBM50376790 (CHEMBL257175) Show SMILES CCc1cccc(CC)c1-c1cc(OC)c2C(CCCc2n1)N[C@@H]1CCCc2ccccc12 |w:16.24| Show InChI InChI=1S/C30H36N2O/c1-4-20-12-8-13-21(5-2)29(20)27-19-28(33-3)30-25(17-10-18-26(30)32-27)31-24-16-9-14-22-11-6-7-15-23(22)24/h6-8,11-13,15,19,24-25,31H,4-5,9-10,14,16-18H2,1-3H3/t24-,25?/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johnson& Johnson PRD Curated by ChEMBL					Assay Description Antagonist activity at human C5a receptor in U937 cells assessed as inhibition of anaphylatoxin-induced intracellular calcium mobilization				Bioorg Med Chem Lett 18: 2544-8 (2008) Article DOI: 10.1016/j.bmcl.2008.03.049 BindingDB Entry DOI: 10.7270/Q2JM2BHD
					More data for this Ligand-Target Pair
C5a anaphylatoxin chemotactic receptor (C5aR) (Homo sapiens (Human))	BDBM50376790 (CHEMBL257175) Show SMILES CCc1cccc(CC)c1-c1cc(OC)c2C(CCCc2n1)N[C@@H]1CCCc2ccccc12 |w:16.24| Show InChI InChI=1S/C30H36N2O/c1-4-20-12-8-13-21(5-2)29(20)27-19-28(33-3)30-25(17-10-18-26(30)32-27)31-24-16-9-14-22-11-6-7-15-23(22)24/h6-8,11-13,15,19,24-25,31H,4-5,9-10,14,16-18H2,1-3H3/t24-,25?/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johnson& Johnson PRD Curated by ChEMBL					Assay Description Antagonist activity at human C5a receptor in U937 cells assessed as inhibition of anaphylatoxin-induced intracellular calcium mobilization				Bioorg Med Chem Lett 18: 2544-8 (2008) Article DOI: 10.1016/j.bmcl.2008.03.049 BindingDB Entry DOI: 10.7270/Q2JM2BHD
					More data for this Ligand-Target Pair