null

SMILES: OC(=O)[C@H](CCN1CC(C1)OCCc1ccc2CCCNc2n1)NC(=O)c1c(Cl)cccc1Cl

InChI Key: InChIKey=LGBPWXCQGKLNDD-FQEVSTJZSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 448883   

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
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448883 (US10696672, Compound 115 | US11634418, Compound 11...) Show SMILES OC(=O)[C@H](CCN1CC(C1)OCCc1ccc2CCCNc2n1)NC(=O)c1c(Cl)cccc1Cl |r| Show InChI InChI=1S/C24H28Cl2N4O4/c25-18-4-1-5-19(26)21(18)23(31)29-20(24(32)33)8-11-30-13-17(14-30)34-12-9-16-7-6-15-3-2-10-27-22(15)28-16/h1,4-7,17,20H,2-3,8-14H2,(H,27,28)(H,29,31)(H,32,33)/t20-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448883 (US10696672, Compound 115 | US11634418, Compound 11...) Show SMILES OC(=O)[C@H](CCN1CC(C1)OCCc1ccc2CCCNc2n1)NC(=O)c1c(Cl)cccc1Cl |r| Show InChI InChI=1S/C24H28Cl2N4O4/c25-18-4-1-5-19(26)21(18)23(31)29-20(24(32)33)8-11-30-13-17(14-30)34-12-9-16-7-6-15-3-2-10-27-22(15)28-16/h1,4-7,17,20H,2-3,8-14H2,(H,27,28)(H,29,31)(H,32,33)/t20-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
Pliant Therapeutics, Inc. US Patent					Assay Description Microplates were coated with recombinant human integrin αvβ6 (2 ug/ml) in PBS (100 ul/well 25° C., overnight). The coating solution was rem...				US Patent US10696672 (2020) BindingDB Entry DOI: 10.7270/Q2TT4V06
					More data for this Ligand-Target Pair