BDBM50545775 CHEMBL4640909

SMILES: C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(nc12)N1CC(C1)[C@H]1CCCN(CCC(F)(F)F)C1

InChI Key: InChIKey=KGFKWWUWKDTEFH-CVEARBPZSA-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 = 50545775   

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 4 (Homo sapiens (Human))	BDBM50545775 (CHEMBL4640909) Show SMILES C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(nc12)N1CC(C1)[C@H]1CCCN(CCC(F)(F)F)C1 |r| Show InChI InChI=1S/C25H26Cl2F3N7/c1-15(19-5-4-18(26)9-20(19)27)37-24-23(21(10-31)34-37)32-11-22(33-24)36-13-17(14-36)16-3-2-7-35(12-16)8-6-25(28,29)30/h4-5,9,11,15-17H,2-3,6-8,12-14H2,1H3/t15-,16+/m1/s1	UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
RAPT Therapeutics Curated by ChEMBL					Assay Description Antagonist activity at CCR4 in human CCRF-CEM cells assessed as inhibition of CCL22-mediated chemotaxis preincubated for 30 mins followed by CCL22 ad...				J Med Chem 63: 8584-8607 (2020)
					More data for this Ligand-Target Pair
C-C chemokine receptor type 4 (Homo sapiens (Human))	BDBM50545775 (CHEMBL4640909) Show SMILES C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(nc12)N1CC(C1)[C@H]1CCCN(CCC(F)(F)F)C1 |r| Show InChI InChI=1S/C25H26Cl2F3N7/c1-15(19-5-4-18(26)9-20(19)27)37-24-23(21(10-31)34-37)32-11-22(33-24)36-13-17(14-36)16-3-2-7-35(12-16)8-6-25(28,29)30/h4-5,9,11,15-17H,2-3,6-8,12-14H2,1H3/t15-,16+/m1/s1	UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	370	n/a	n/a	n/a	n/a	n/a	n/a
RAPT Therapeutics Curated by ChEMBL					Assay Description Antagonist activity at human CCR4 expressed in rat chem-5 cells assessed as inhibition of CCL22-induced calcium flux measured at 2.5 secs time interv...				J Med Chem 63: 8584-8607 (2020)
					More data for this Ligand-Target Pair