BDBM126170 US8778957, 3

SMILES: CC1(C)CN(Cc2ccc3cc4CC5(Cc4cc3n2)C(=O)Nc2ncccc52)[C@@H](Cc2ccccc2)C(=O)N1

InChI Key: InChIKey=YSPLXBLCPIVGCZ-BSXJZHEVSA-N

Data: 1 KI

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 126170   

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 gene-related peptide (CGRP alpha) (Homo sapiens (Human))	BDBM126170 (US8778957, 3) Show SMILES CC1(C)CN(Cc2ccc3cc4CC5(Cc4cc3n2)C(=O)Nc2ncccc52)[C@@H](Cc2ccccc2)C(=O)N1 Show InChI InChI=1S/C32H31N5O2/c1-31(2)19-37(27(29(38)36-31)13-20-7-4-3-5-8-20)18-24-11-10-21-14-22-16-32(17-23(22)15-26(21)34-24)25-9-6-12-33-28(25)35-30(32)39/h3-12,14-15,27H,13,16-19H2,1-2H3,(H,36,38)(H,33,35,39)/t27-,32?/m0/s1	Reactome pathway UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.770	-12.4	n/a	n/a	n/a	n/a	n/a	7.4	25
Merck Sharp & Dohme Corp. US Patent					Assay Description Cells expressing recombinant human CL receptor/RAMP1 were washed with PBS and harvested in harvest buffer containing 50 mM HEPES, 1 mM EDTA and Compl...				US Patent US8778957 (2014) BindingDB Entry DOI: 10.7270/Q29022G8
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