Compile Data Set for Download or QSAR

Found 2 hits of ic50 data for polymerid = 50000358   

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
Kallikrein-2 (Homo sapiens (Human))	BDBM50292533 (CHEMBL446790 | Fukugetin) Show SMILES Oc1ccc(cc1)[C@@H]1Oc2cc(O)cc(O)c2C(=O)[C@H]1c1c(O)cc(O)c2C(=O)CC(Oc12)c1ccc(O)c(O)c1 |r| Show InChI InChI=1S/C30H22O11/c31-14-4-1-12(2-5-14)29-27(28(39)25-18(35)8-15(32)9-23(25)41-29)26-20(37)10-19(36)24-21(38)11-22(40-30(24)26)13-3-6-16(33)17(34)7-13/h1-10,22,27,29,31-37H,11H2/t22?,27-,29+/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Campus Inc Curated by ChEMBL					Assay Description Inhibition of human tissue kallikrein-2 expressed in baculovirus infected insect cells using Abz-KLRSSQ-EDDnp as substrate preincubated for 10 mins f...				Bioorg Med Chem Lett 26: 1485-9 (2016) Article DOI: 10.1016/j.bmcl.2016.01.039 BindingDB Entry DOI: 10.7270/Q2862J9K
					More data for this Ligand-Target Pair
Kallikrein-2 (Homo sapiens (Human))	BDBM50326050 (CHEMBL1240617) Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,wU:78.83,3.3,38.39,59.61,16.24,wD:73.78,45.45,27.35,7.12,83.87,(16.62,-15.91,;15.28,-16.68,;13.95,-15.91,;15.28,-18.23,;13.95,-18.99,;12.61,-18.23,;12.61,-16.7,;11.28,-19,;11.28,-20.54,;12.61,-21.31,;12.61,-22.86,;13.93,-23.62,;13.94,-25.16,;9.95,-18.22,;8.61,-18.99,;8.61,-20.53,;7.28,-18.22,;7.28,-16.68,;8.61,-15.91,;9.95,-16.69,;11.28,-15.92,;11.29,-14.38,;9.95,-13.61,;8.62,-14.37,;5.94,-18.98,;4.6,-18.23,;4.6,-16.69,;3.27,-19,;3.27,-20.54,;4.6,-21.32,;4.6,-22.85,;5.94,-23.6,;5.94,-25.14,;4.6,-25.92,;7.27,-25.9,;1.95,-18.22,;.61,-18.99,;.61,-20.53,;-.72,-18.22,;-2.04,-18.97,;-.72,-16.68,;.62,-15.89,;16.62,-18.99,;16.62,-20.53,;17.95,-18.22,;19.28,-19,;19.28,-20.54,;20.56,-21.41,;22,-20.88,;22.94,-22.1,;22.08,-23.38,;22.45,-24.87,;21.33,-25.95,;19.85,-25.51,;19.48,-24.02,;20.6,-22.96,;20.61,-18.23,;20.61,-16.7,;21.95,-18.99,;23.29,-18.22,;23.29,-16.69,;24.51,-15.74,;25.76,-16.65,;27.01,-15.74,;26.53,-14.28,;27.29,-12.94,;26.53,-11.61,;24.99,-11.61,;24.21,-12.94,;24.98,-14.28,;24.62,-18.99,;24.62,-20.54,;25.96,-18.23,;27.29,-19,;27.29,-20.54,;28.62,-18.24,;28.62,-16.69,;29.96,-18.99,;31.29,-18.22,;31.29,-16.68,;32.63,-18.99,;32.63,-20.53,;33.96,-18.22,;35.3,-18.99,;35.3,-20.53,;36.63,-21.31,;37.97,-20.54,;39.3,-21.31,;39.3,-22.85,;37.96,-23.62,;36.63,-22.85,;36.63,-18.22,;37.97,-18.99,;36.63,-16.69,)| Show InChI InChI=1S/C66H88N16O12/c1-37(2)55(82-60(88)49(26-15-16-28-67)77-62(90)51(30-40-18-7-5-8-19-40)78-59(87)50(27-17-29-71-66(69)70)76-58(86)46(68)36-83)64(92)80-53(33-43-35-73-48-25-14-12-23-45(43)48)63(91)79-52(32-42-34-72-47-24-13-11-22-44(42)47)61(89)75-38(3)56(84)74-39(4)57(85)81-54(65(93)94)31-41-20-9-6-10-21-41/h5-14,18-25,34-35,37-39,46,49-55,72-73,83H,15-17,26-33,36,67-68H2,1-4H3,(H,74,84)(H,75,89)(H,76,86)(H,77,90)(H,78,87)(H,79,91)(H,80,92)(H,81,85)(H,82,88)(H,93,94)(H4,69,70,71)/t38-,39-,46-,49-,50-,51-,52-,53-,54-,55-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Molecular Biology, Medical Research Council Curated by ChEMBL					Assay Description Binding affinity to human kallikrein 2				Nat Chem Biol 5: 502-7 (2009) Article DOI: 10.1038/nchembio.184 BindingDB Entry DOI: 10.7270/Q2Z60P9P
					More data for this Ligand-Target Pair