null

SMILES: CC(=O)c1cc(ccc1-c1c2ccc(N)c(c2oc2c(c(=N)ccc12)S(O)(=O)=O)S(O)(=O)=O)C(=O)NCCCCCCn1cc(CCCCN2CCC(CC2)c2ccc(cc2)-c2cc(cc3cc(ccc23)-c2ccc(cc2)C(F)(F)F)C(O)=O)nn1

InChI Key:

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50614414   

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
P2Y purinoceptor 14 (Homo sapiens (Human))	BDBM50614414 (CHEMBL5271821) Show SMILES CC(=O)c1cc(ccc1-c1c2ccc(N)c(c2oc2c(c(=N)ccc12)S(O)(=O)=O)S(O)(=O)=O)C(=O)NCCCCCCn1cc(CCCCN2CCC(CC2)c2ccc(cc2)-c2cc(cc3cc(ccc23)-c2ccc(cc2)C(F)(F)F)C(O)=O)nn1 |(-14.57,-12.99,;-14.18,-11.51,;-15.51,-10.74,;-12.69,-11.11,;-11.6,-12.19,;-10.12,-11.8,;-9.72,-10.3,;-10.81,-9.22,;-12.29,-9.62,;-13.38,-8.53,;-12.98,-7.04,;-11.49,-6.63,;-11.11,-5.14,;-12.2,-4.06,;-11.8,-2.57,;-13.68,-4.47,;-14.07,-5.95,;-15.55,-6.35,;-15.95,-7.84,;-17.44,-8.24,;-17.83,-9.72,;-19.32,-10.12,;-16.75,-10.8,;-15.26,-10.41,;-14.87,-8.93,;-18.53,-7.15,;-20.02,-7.55,;-18.93,-5.66,;-17.44,-6.06,;-14.77,-3.38,;-16.26,-3.78,;-15.17,-1.89,;-13.68,-2.29,;-9.03,-12.88,;-9.43,-14.37,;-7.54,-12.49,;-7.14,-11,;-5.65,-10.6,;-5.25,-9.11,;-3.77,-8.71,;-3.37,-7.23,;-1.88,-6.83,;-1.48,-5.34,;.02,-4.87,;.02,-3.33,;1.35,-2.56,;2.69,-3.33,;4.02,-2.56,;5.35,-3.33,;6.69,-2.56,;8.02,-3.33,;9.35,-2.57,;9.35,-1.03,;8.01,-.25,;6.69,-1.03,;10.69,-.26,;12.02,-1.03,;13.35,-.26,;13.35,1.28,;12.01,2.05,;10.68,1.28,;14.69,2.05,;16.02,1.29,;17.35,2.06,;17.35,3.6,;16.02,4.37,;16.02,5.9,;14.69,6.67,;13.35,5.9,;13.36,4.36,;14.69,3.6,;14.69,8.21,;16.01,8.98,;16.01,10.52,;14.68,11.29,;13.35,10.52,;13.35,8.98,;14.68,12.83,;13.35,13.6,;16.02,13.6,;14.68,14.37,;18.68,1.29,;18.68,-.25,;20.02,2.06,;-1.44,-2.87,;-2.36,-4.12,)| Show InChI	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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