BDBM50518107 CHEMBL4464639

SMILES: CC(=O)C1=C(O)C(=O)N(C1C1CCCCC1)c1ccc(C)c(C)c1

InChI Key: InChIKey=QITUABVWECHKHY-UHFFFAOYSA-N

Data: 4 KI

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 4 hits for monomerid = 50518107   

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
C-C chemokine receptor type 2 (Homo sapiens (Human))	BDBM50518107 (CHEMBL4464639) Show SMILES CC(=O)C1=C(O)C(=O)N(C1C1CCCCC1)c1ccc(C)c(C)c1 |c:3| Show InChI InChI=1S/C20H25NO3/c1-12-9-10-16(11-13(12)2)21-18(15-7-5-4-6-8-15)17(14(3)22)19(23)20(21)24/h9-11,15,18,23H,4-8H2,1-3H3	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University Curated by ChEMBL					Assay Description Displacement of [3H]-CCR2-RA-[R] from human TEV protease site linked CCR2b expressed in human U20S cell membranes co-expressing Gal4-VP16 transcripti...				J Med Chem 61: 9146-9161 (2018) Article DOI: 10.1021/acs.jmedchem.8b00605
					More data for this Ligand-Target Pair
C-C chemokine receptor type 2 (Homo sapiens (Human))	BDBM50518107 (CHEMBL4464639) Show SMILES CC(=O)C1=C(O)C(=O)N(C1C1CCCCC1)c1ccc(C)c(C)c1 |c:3| Show InChI InChI=1S/C20H25NO3/c1-12-9-10-16(11-13(12)2)21-18(15-7-5-4-6-8-15)17(14(3)22)19(23)20(21)24/h9-11,15,18,23H,4-8H2,1-3H3	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University Curated by ChEMBL					Assay Description Displacement of [3H]-CCR2-RA-[R] from human TEV protease site linked CCR2b expressed in human U20S cell membranes co-expressing Gal4-VP16 transcripti...				J Med Chem 61: 9146-9161 (2018) Article DOI: 10.1021/acs.jmedchem.8b00605
					More data for this Ligand-Target Pair
C-C chemokine receptor type 1 (Homo sapiens (Human))	BDBM50518107 (CHEMBL4464639) Show SMILES CC(=O)C1=C(O)C(=O)N(C1C1CCCCC1)c1ccc(C)c(C)c1 |c:3| Show InChI InChI=1S/C20H25NO3/c1-12-9-10-16(11-13(12)2)21-18(15-7-5-4-6-8-15)17(14(3)22)19(23)20(21)24/h9-11,15,18,23H,4-8H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	43	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University Curated by ChEMBL					Assay Description Displacement of [3H]-CCR2-RA-[R] from human TEV protease site linked CCR1 expressed in human U20S cell membranes co-expressing Gal4-VP16 transcriptio...				J Med Chem 61: 9146-9161 (2018) Article DOI: 10.1021/acs.jmedchem.8b00605
					More data for this Ligand-Target Pair
C-C chemokine receptor type 1 (Homo sapiens (Human))	BDBM50518107 (CHEMBL4464639) Show SMILES CC(=O)C1=C(O)C(=O)N(C1C1CCCCC1)c1ccc(C)c(C)c1 |c:3| Show InChI InChI=1S/C20H25NO3/c1-12-9-10-16(11-13(12)2)21-18(15-7-5-4-6-8-15)17(14(3)22)19(23)20(21)24/h9-11,15,18,23H,4-8H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	43	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University Curated by ChEMBL					Assay Description Displacement of [3H]-CCR2-RA-[R] from human TEV protease site linked CCR1 expressed in human U20S cell membranes co-expressing Gal4-VP16 transcriptio...				J Med Chem 61: 9146-9161 (2018) Article DOI: 10.1021/acs.jmedchem.8b00605
					More data for this Ligand-Target Pair