Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cyclin-T1' and Ligand = 'BDBM126473'   

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
Cyclin-T1 (Homo sapiens (Human))	BDBM126473 (US8778951, 283) Show SMILES COCCN[C@H]1CC[C@@H](CC1)Nc1cc(c(Cl)cn1)-c1nc(NCC2CCOCC2)ccc1F |r,wU:8.11,wD:5.4,(7.64,1.68,;6.3,2.45,;4.97,1.68,;3.63,2.45,;2.3,1.68,;.97,2.45,;.97,3.99,;-.37,4.76,;-1.7,3.99,;-1.7,2.45,;-.37,1.68,;-3.03,4.76,;-4.37,3.99,;-4.37,2.45,;-5.7,1.68,;-7.04,2.45,;-8.37,1.68,;-7.04,3.99,;-5.7,4.76,;-5.7,.14,;-4.37,-.63,;-4.37,-2.17,;-3.03,-2.94,;-1.7,-2.17,;-.37,-2.94,;-.37,-4.48,;.97,-5.25,;2.3,-4.48,;2.3,-2.94,;.97,-2.17,;-5.7,-2.94,;-7.04,-2.17,;-7.04,-.63,;-8.37,.14,)| Show InChI InChI=1S/C25H35ClFN5O2/c1-33-13-10-28-18-2-4-19(5-3-18)31-24-14-20(21(26)16-30-24)25-22(27)6-7-23(32-25)29-15-17-8-11-34-12-9-17/h6-7,14,16-19,28H,2-5,8-13,15H2,1H3,(H,29,32)(H,30,31)/t18-,19-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	0.00100	n/a	n/a	n/a	n/a	n/a	n/a
Novartis AG US Patent					Assay Description Cdk9/cyclinT1 is purchased from Millipore, cat #14-685. The final total protein concentration in the assay 4 nM. The 5TAMRA-cdk7tide peptide substrat...				US Patent US8778951 (2014) BindingDB Entry DOI: 10.7270/Q25B014T
					More data for this Ligand-Target Pair