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SMILES: Cc1ccc(CNC(=O)c2ccccc2NC(=O)CN2CCC3C=CC=CC3C2)cc1

InChI Key: InChIKey=HZKMGPCRORUHHA-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 314077   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Integrin alpha-4/beta-7


(Homo sapiens (Human))		BDBM314077
PNG
(US9610264, Compound 11)
Show SMILES Cc1ccc(CNC(=O)c2ccccc2NC(=O)CN2CCC3C=CC=CC3C2)cc1 |c:24,26|
Show InChI InChI=1S/C26H29N3O2/c1-19-10-12-20(13-11-19)16-27-26(31)23-8-4-5-9-24(23)28-25(30)18-29-15-14-21-6-2-3-7-22(21)17-29/h2-13,21-22H,14-18H2,1H3,(H,27,31)(H,28,30)
PDB

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PC cid
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US Patent
n/an/a 2.19n/an/an/an/an/an/a



KFLP BIOTECH, LLC

US Patent


Assay Description
The studies began by screening for the optimal protein concentrations for the method. The studies were conducted in goat anti-mouse IgG coated black ...

US Patent US9610264 (2017)


BindingDB Entry DOI: 10.7270/Q2KH0QD4
More data for this
Ligand-Target Pair