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SMILES: Cc1nn(C)c(C)c1-c1cccc2c(CCCOc3cc(C)c(Cl)c(C)c3)c([nH]c12)C(=O)N[C@H]1CCCC[C@H]1OC=O

InChI Key:

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 429185   

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
Induced myeloid leukemia cell differentiation protein Mcl-1 (Homo sapiens (Human))	BDBM429185 (US10533010, Example I-316 | US11208415, Example I-...) Show SMILES Cc1nn(C)c(C)c1-c1cccc2c(CCCOc3cc(C)c(Cl)c(C)c3)c([nH]c12)C(=O)N[C@H]1CCCC[C@H]1OC=O |r,wD:33.36,38.43,(-1.45,5.31,;-2.78,6.08,;-3.26,7.54,;-4.8,7.54,;-5.57,8.88,;-5.27,6.08,;-6.61,5.31,;-4.03,5.17,;-4.03,3.63,;-5.36,2.86,;-5.36,1.32,;-4.03,.55,;-2.69,1.32,;-1.23,.85,;-.83,-.64,;.66,-1.04,;1.06,-2.53,;2.54,-2.93,;2.94,-4.41,;4.43,-4.81,;4.83,-6.3,;6.32,-6.7,;3.74,-7.39,;4.14,-8.88,;2.25,-6.99,;1.16,-8.08,;1.85,-5.5,;-.32,2.09,;-1.23,3.34,;-2.69,2.86,;1.22,2.09,;1.99,.76,;1.99,3.43,;3.53,3.43,;4.3,2.09,;5.84,2.09,;6.61,3.43,;5.84,4.76,;4.27,4.81,;3.5,6.14,;4.27,7.48,;5.81,7.47,)| Show InChI	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<50	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Compound affinity was measured using a fluorescence polarization anisotropy competition assay. Anisotropy measurements were carried out in 384-well, ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2RX9G8J
					More data for this Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (Homo sapiens (Human))	BDBM429185 (US10533010, Example I-316 | US11208415, Example I-...) Show SMILES Cc1nn(C)c(C)c1-c1cccc2c(CCCOc3cc(C)c(Cl)c(C)c3)c([nH]c12)C(=O)N[C@H]1CCCC[C@H]1OC=O |r,wD:33.36,38.43,(-1.45,5.31,;-2.78,6.08,;-3.26,7.54,;-4.8,7.54,;-5.57,8.88,;-5.27,6.08,;-6.61,5.31,;-4.03,5.17,;-4.03,3.63,;-5.36,2.86,;-5.36,1.32,;-4.03,.55,;-2.69,1.32,;-1.23,.85,;-.83,-.64,;.66,-1.04,;1.06,-2.53,;2.54,-2.93,;2.94,-4.41,;4.43,-4.81,;4.83,-6.3,;6.32,-6.7,;3.74,-7.39,;4.14,-8.88,;2.25,-6.99,;1.16,-8.08,;1.85,-5.5,;-.32,2.09,;-1.23,3.34,;-2.69,2.86,;1.22,2.09,;1.99,.76,;1.99,3.43,;3.53,3.43,;4.3,2.09,;5.84,2.09,;6.61,3.43,;5.84,4.76,;4.27,4.81,;3.5,6.14,;4.27,7.48,;5.81,7.47,)| Show InChI	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<50	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vanderbilt University US Patent					Assay Description Compound affinity was measured using a fluorescence polarization anisotropy competition assay. Anisotropy measurements were carried out in 384-well, ...				US Patent US10533010 (2020) BindingDB Entry DOI: 10.7270/Q2T72KVG
					More data for this Ligand-Target Pair