BDBM50030559 7S,8S-(betaMeF)2SP::CHEMBL2371143::FVPTDVG-Tic-FAF

SMILES: [#6]-[#16]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6@@H](-[#6])-c1ccccc1)-[#6@@H](-[#6])-c1ccccc1)-[#6](-[#7])=O

InChI Key: InChIKey=BOEJIYJVJIEUMU-YHRXRORMSA-N

Data: 1 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 1 hit for monomerid = 50030559   

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 type 1 receptor (Homo sapiens (Human))	BDBM50030559 (7S,8S-(betaMeF)2SP | CHEMBL2371143 | FVPTDVG-Tic-F...) Show SMILES [#6]-[#16]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6@@H](-[#6])-c1ccccc1)-[#6@@H](-[#6])-c1ccccc1)-[#6](-[#7])=O Show InChI InChI=1S/C65H102N18O13S/c1-37(2)35-47(58(90)76-43(55(70)87)29-34-97-5)75-52(86)36-74-61(93)53(38(3)40-17-8-6-9-18-40)81-62(94)54(39(4)41-19-10-7-11-20-41)80-57(89)45(26-28-51(69)85)77-56(88)44(25-27-50(68)84)78-59(91)49-24-16-33-83(49)64(96)46(22-12-13-30-66)79-60(92)48-23-15-32-82(48)63(95)42(67)21-14-31-73-65(71)72/h6-11,17-20,37-39,42-49,53-54H,12-16,21-36,66-67H2,1-5H3,(H2,68,84)(H2,69,85)(H2,70,87)(H,74,93)(H,75,86)(H,76,90)(H,77,88)(H,78,91)(H,79,92)(H,80,89)(H,81,94)(H4,71,72,73)/t38-,39-,42-,43-,44-,45-,46-,47-,48-,49-,53-,54-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	146	n/a	n/a	n/a	n/a	n/a	n/a
ETH Zürich Curated by ChEMBL					Assay Description CGRP1 receptor affinity on human neuroblastoma cells SK-N-MC, which selectively express the human CGRP1 receptor.				J Med Chem 41: 117-23 (1998) Article DOI: 10.1021/jm970533r BindingDB Entry DOI: 10.7270/Q2736Q0S
					More data for this Ligand-Target Pair