BDBM50518087 CHEMBL4471583

SMILES: Cc1ccc(cc1)N1C(C2CCCCC2)C(C(=O)C2CC2)=C(O)C1=O

InChI Key: InChIKey=VKUIPZIEQFUJHB-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 = 50518087   

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 1 (Homo sapiens (Human))	BDBM50518087 (CHEMBL4471583) Show SMILES Cc1ccc(cc1)N1C(C2CCCCC2)C(C(=O)C2CC2)=C(O)C1=O |t:23| Show InChI InChI=1S/C21H25NO3/c1-13-7-11-16(12-8-13)22-18(14-5-3-2-4-6-14)17(20(24)21(22)25)19(23)15-9-10-15/h7-8,11-12,14-15,18,24H,2-6,9-10H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL 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 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))	BDBM50518087 (CHEMBL4471583) Show SMILES Cc1ccc(cc1)N1C(C2CCCCC2)C(C(=O)C2CC2)=C(O)C1=O |t:23| Show InChI InChI=1S/C21H25NO3/c1-13-7-11-16(12-8-13)22-18(14-5-3-2-4-6-14)17(20(24)21(22)25)19(23)15-9-10-15/h7-8,11-12,14-15,18,24H,2-6,9-10H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	19	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 2 (Homo sapiens (Human))	BDBM50518087 (CHEMBL4471583) Show SMILES Cc1ccc(cc1)N1C(C2CCCCC2)C(C(=O)C2CC2)=C(O)C1=O |t:23| Show InChI InChI=1S/C21H25NO3/c1-13-7-11-16(12-8-13)22-18(14-5-3-2-4-6-14)17(20(24)21(22)25)19(23)15-9-10-15/h7-8,11-12,14-15,18,24H,2-6,9-10H2,1H3	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	158	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))	BDBM50518087 (CHEMBL4471583) Show SMILES Cc1ccc(cc1)N1C(C2CCCCC2)C(C(=O)C2CC2)=C(O)C1=O |t:23| Show InChI InChI=1S/C21H25NO3/c1-13-7-11-16(12-8-13)22-18(14-5-3-2-4-6-14)17(20(24)21(22)25)19(23)15-9-10-15/h7-8,11-12,14-15,18,24H,2-6,9-10H2,1H3	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	160	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