BDBM50373787 CHEMBL255998

SMILES: COCCn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccn[nH]1

InChI Key: InChIKey=GYGWNQAEMBWBRJ-UHFFFAOYSA-N

Data: 1 KI  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 3 hits for monomerid = 50373787   

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
CGRP type 1 receptor (Homo sapiens (Human))	BDBM50373787 (CHEMBL255998) Show SMILES COCCn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccn[nH]1 Show InChI InChI=1S/C23H26N8O4/c1-35-12-11-30-14-15(17-4-8-25-28-17)13-18(21(30)32)26-22(33)29-9-5-16(6-10-29)31-19-3-2-7-24-20(19)27-23(31)34/h2-4,7-8,13-14,16H,5-6,9-12H2,1H3,(H,25,28)(H,26,33)(H,24,27,34)	PDB GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	140	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1				Bioorg Med Chem Lett 18: 755-8 (2008) Article DOI: 10.1016/j.bmcl.2007.11.042 BindingDB Entry DOI: 10.7270/Q2T43TZ2
					More data for this Ligand-Target Pair
CGRP type 1 receptor (Homo sapiens (Human))	BDBM50373787 (CHEMBL255998) Show SMILES COCCn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccn[nH]1 Show InChI InChI=1S/C23H26N8O4/c1-35-12-11-30-14-15(17-4-8-25-28-17)13-18(21(30)32)26-22(33)29-9-5-16(6-10-29)31-19-3-2-7-24-20(19)27-23(31)34/h2-4,7-8,13-14,16H,5-6,9-12H2,1H3,(H,25,28)(H,26,33)(H,24,27,34)	PDB GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	394	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation in presence of 50% human serum by cell based ...				Bioorg Med Chem Lett 18: 755-8 (2008) Article DOI: 10.1016/j.bmcl.2007.11.042 BindingDB Entry DOI: 10.7270/Q2T43TZ2
					More data for this Ligand-Target Pair
CGRP type 1 receptor (Homo sapiens (Human))	BDBM50373787 (CHEMBL255998) Show SMILES COCCn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccn[nH]1 Show InChI InChI=1S/C23H26N8O4/c1-35-12-11-30-14-15(17-4-8-25-28-17)13-18(21(30)32)26-22(33)29-9-5-16(6-10-29)31-19-3-2-7-24-20(19)27-23(31)34/h2-4,7-8,13-14,16H,5-6,9-12H2,1H3,(H,25,28)(H,26,33)(H,24,27,34)	PDB GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	307	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay				Bioorg Med Chem Lett 18: 755-8 (2008) Article DOI: 10.1016/j.bmcl.2007.11.042 BindingDB Entry DOI: 10.7270/Q2T43TZ2
					More data for this Ligand-Target Pair