Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(1A) dopamine receptor' and Ligand = 'BDBM200975'   

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
D(1A) dopamine receptor (Homo sapiens (Human))	BDBM200975 (8-[4-(4,6-dimethylpyrimidin-5-yl)-3- methylphenoxy...) Show SMILES Cc1cc(Oc2nccc3cccnc23)ccc1-c1c(C)ncnc1C |(.67,4.23,;.67,2.69,;-.67,1.93,;-.67,.38,;-2,-.38,;-2,-1.93,;-.67,-2.69,;-.67,-4.23,;-2,-5,;-3.33,-4.23,;-4.67,-5,;-6,-4.23,;-6,-2.69,;-4.67,-1.93,;-3.33,-2.69,;.67,-.38,;2,.38,;2,1.93,;3.33,2.69,;3.33,4.23,;2,5,;4.67,5,;6,4.23,;6,2.69,;4.67,1.93,;4.67,.38,)| Show InChI InChI=1S/C21H18N4O/c1-13-11-17(6-7-18(13)19-14(2)24-12-25-15(19)3)26-21-20-16(8-10-23-21)5-4-9-22-20/h4-12H,1-3H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	105	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
Pfizer Inc. US Patent					Assay Description The affinity of the compounds described herein was determined by competition binding assays similar to those described in Ryman-Rasmussen et al., Dif...				US Patent US9540352 (2017) BindingDB Entry DOI: 10.7270/Q2X34VND
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