BDBM362174 US9833448, Example 17

SMILES: Fc1cccc([C@@H]2C[C@H](NC(=O)c3cnc4C[C@]5(Cc4c3)C(=O)Nc3ncccc53)C(=O)N(CC3CCC3)C2)c1F

InChI Key: InChIKey=SUKIQFSJOWYYTQ-XMBZSLMXSA-N

Data: 1 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 1 hit for monomerid = 362174   

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
Calcitonin receptor-like receptor (CLR) (Homo sapiens (Human))	BDBM362174 (US9833448, Example 17) Show SMILES Fc1cccc([C@@H]2C[C@H](NC(=O)c3cnc4C[C@]5(Cc4c3)C(=O)Nc3ncccc53)C(=O)N(CC3CCC3)C2)c1F |r| Show InChI InChI=1S/C31H29F2N5O3/c32-23-8-2-6-21(26(23)33)20-11-24(29(40)38(16-20)15-17-4-1-5-17)36-28(39)19-10-18-12-31(13-25(18)35-14-19)22-7-3-9-34-27(22)37-30(31)41/h2-3,6-10,14,17,20,24H,1,4-5,11-13,15-16H2,(H,36,39)(H,34,37,41)/t20-,24+,31+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	UniChem	US Patent	0.0550	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Cells were resuspended in DMEM/F12 (Hyclone) supplemented with 1 g/L BSA and 300 μM isobutyl-methylxanthine. Cells were then plated in a 384-wel...				US Patent US9833448 (2017) BindingDB Entry DOI: 10.7270/Q2BP052K
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