Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 563.0 BDBM495053

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 2 hits in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/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))	BDBM495053 (US10995084, Ex. No. 2B-11) Show SMILES C[C@@H](NC(=O)c1cnc(Oc2cc(C)n[nH]c2=O)c(C)c1)C(=O)N1[C@@H](CC[C@@H]1C(C)(C)C#N)c1cccc(Cl)c1 |r| Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.130	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
KISSEI PHARMACEUTICAL CO., LTD. US Patent					Assay Description The binding affinity assay of compounds for human CGRP receptor was carried out by inhibition of radiolabeled ligand [125I]-CGRP binding in human neu...				US Patent US10995084 (2021) BindingDB Entry DOI: 10.7270/Q24T6NH0
					More data for this Ligand-Target Pair
Calcitonin gene-related peptide type 1 receptor (Homo sapiens (Human))	BDBM495053 (US10995084, Ex. No. 2B-11) Show SMILES C[C@@H](NC(=O)c1cnc(Oc2cc(C)n[nH]c2=O)c(C)c1)C(=O)N1[C@@H](CC[C@@H]1C(C)(C)C#N)c1cccc(Cl)c1 |r| Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.0300	n/a	n/a	n/a	n/a	n/a	n/a
KISSEI PHARMACEUTICAL CO., LTD. US Patent					Assay Description The binding affinity assay of compounds for human CGRP receptor was carried out by inhibition of radiolabeled ligand [125I]-CGRP binding in human neu...				US Patent US10995084 (2021) BindingDB Entry DOI: 10.7270/Q24T6NH0
					More data for this Ligand-Target Pair