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Compile Data Set for Download or QSAR

Found 26 hits of ic50 data for polymerid = 50001376   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50500099
PNG
(CHEMBL3741765)
Show SMILES OC(=O)c1ccc(NC(c2ccc3ccccc3c2O)c2c(F)cc(Br)cc2F)cc1
Show InChI InChI=1S/C24H16BrF2NO3/c25-15-11-19(26)21(20(27)12-15)22(28-16-8-5-14(6-9-16)24(30)31)18-10-7-13-3-1-2-4-17(13)23(18)29/h1-12,22,28-29H,(H,30,31)
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n/an/a 3.80E+3n/an/an/an/an/an/a



New York University Abu Dhabi

Curated by ChEMBL


Assay Description
Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnesyl)QIIM and ABZ-KSKTKC(farnesyl)VIQI as substrate assessed as residua...

Bioorg Med Chem 24: 160-78 (2016)


Article DOI: 10.1016/j.bmc.2015.11.043
BindingDB Entry DOI: 10.7270/Q2NS0XXQ
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50500092
PNG
(CHEMBL3741937)
Show SMILES OC(=O)c1ccc(NC(c2ccc(Br)cc2)c2ccc3ccccc3c2O)cc1
Show InChI InChI=1S/C24H18BrNO3/c25-18-10-5-16(6-11-18)22(26-19-12-7-17(8-13-19)24(28)29)21-14-9-15-3-1-2-4-20(15)23(21)27/h1-14,22,26-27H,(H,28,29)
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n/an/a 3.90E+3n/an/an/an/an/an/a



New York University Abu Dhabi

Curated by ChEMBL


Assay Description
Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnesyl)QIIM and ABZ-KSKTKC(farnesyl)VIQI as substrate assessed as residua...

Bioorg Med Chem 24: 160-78 (2016)


Article DOI: 10.1016/j.bmc.2015.11.043
BindingDB Entry DOI: 10.7270/Q2NS0XXQ
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50500097
PNG
(CHEMBL3740962)
Show SMILES OC(=O)c1ccc(NC(c2ccccc2)c2ccc3ccccc3c2O)cc1
Show InChI InChI=1S/C24H19NO3/c26-23-20-9-5-4-6-16(20)12-15-21(23)22(17-7-2-1-3-8-17)25-19-13-10-18(11-14-19)24(27)28/h1-15,22,25-26H,(H,27,28)
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n/an/a 4.20E+3n/an/an/an/an/an/a



New York University Abu Dhabi

Curated by ChEMBL


Assay Description
Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnesyl)QIIM and ABZ-KSKTKC(farnesyl)VIQI as substrate assessed as residua...

Bioorg Med Chem 24: 160-78 (2016)


Article DOI: 10.1016/j.bmc.2015.11.043
BindingDB Entry DOI: 10.7270/Q2NS0XXQ
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50500105
PNG
(CHEMBL3740249)
Show SMILES Oc1c(ccc2ccccc12)C(Nc1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H19NO/c25-23-20-14-8-7-9-17(20)15-16-21(23)22(18-10-3-1-4-11-18)24-19-12-5-2-6-13-19/h1-16,22,24-25H
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n/an/a 4.90E+3n/an/an/an/an/an/a



New York University Abu Dhabi

Curated by ChEMBL


Assay Description
Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnesyl)QIIM and ABZ-KSKTKC(farnesyl)VIQI as substrate assessed as residua...

Bioorg Med Chem 24: 160-78 (2016)


Article DOI: 10.1016/j.bmc.2015.11.043
BindingDB Entry DOI: 10.7270/Q2NS0XXQ
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50500103
PNG
(CHEMBL3742211)
Show SMILES CC(C)(C)c1ccc(NC(c2ccccc2)c2ccc3ccccc3c2O)cc1
Show InChI InChI=1S/C27H27NO/c1-27(2,3)21-14-16-22(17-15-21)28-25(20-10-5-4-6-11-20)24-18-13-19-9-7-8-12-23(19)26(24)29/h4-18,25,28-29H,1-3H3
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n/an/a 5.00E+3n/an/an/an/an/an/a



New York University Abu Dhabi

Curated by ChEMBL


Assay Description
Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnesyl)QIIM and ABZ-KSKTKC(farnesyl)VIQI as substrate assessed as residua...

Bioorg Med Chem 24: 160-78 (2016)


Article DOI: 10.1016/j.bmc.2015.11.043
BindingDB Entry DOI: 10.7270/Q2NS0XXQ
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50500098
PNG
(CHEMBL3741101)
Show SMILES OC(=O)c1cccc(NC(c2ccccc2)c2ccc3ccccc3c2O)c1
Show InChI InChI=1S/C24H19NO3/c26-23-20-12-5-4-7-16(20)13-14-21(23)22(17-8-2-1-3-9-17)25-19-11-6-10-18(15-19)24(27)28/h1-15,22,25-26H,(H,27,28)
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n/an/a 5.30E+3n/an/an/an/an/an/a



New York University Abu Dhabi

Curated by ChEMBL


Assay Description
Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnesyl)QIIM and ABZ-KSKTKC(farnesyl)VIQI as substrate assessed as residua...

Bioorg Med Chem 24: 160-78 (2016)


Article DOI: 10.1016/j.bmc.2015.11.043
BindingDB Entry DOI: 10.7270/Q2NS0XXQ
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50500106
PNG
(CHEMBL3741673)
Show SMILES Oc1c(cc(Br)c2ccccc12)C(Nc1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H18BrNO/c24-21-15-20(23(26)19-14-8-7-13-18(19)21)22(16-9-3-1-4-10-16)25-17-11-5-2-6-12-17/h1-15,22,25-26H
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n/an/a 5.40E+3n/an/an/an/an/an/a



New York University Abu Dhabi

Curated by ChEMBL


Assay Description
Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnesyl)QIIM and ABZ-KSKTKC(farnesyl)VIQI as substrate assessed as residua...

Bioorg Med Chem 24: 160-78 (2016)


Article DOI: 10.1016/j.bmc.2015.11.043
BindingDB Entry DOI: 10.7270/Q2NS0XXQ
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50500094
PNG
(CHEMBL3740203)
Show SMILES OC(=O)c1ccc(NC(c2ccc(Br)cc2)c2ccc3cccnc3c2O)cc1
Show InChI InChI=1S/C23H17BrN2O3/c24-17-8-3-15(4-9-17)20(26-18-10-5-16(6-11-18)23(28)29)19-12-7-14-2-1-13-25-21(14)22(19)27/h1-13,20,26-27H,(H,28,29)
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n/an/a 6.70E+3n/an/an/an/an/an/a



New York University Abu Dhabi

Curated by ChEMBL


Assay Description
Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnesyl)QIIM and ABZ-KSKTKC(farnesyl)VIQI as substrate assessed as residua...

Bioorg Med Chem 24: 160-78 (2016)


Article DOI: 10.1016/j.bmc.2015.11.043
BindingDB Entry DOI: 10.7270/Q2NS0XXQ
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50500101
PNG
(CHEMBL1979298)
Show SMILES OC(=O)c1ccc(NC(c2ccccc2)c2ccc3cccnc3c2O)cc1
Show InChI InChI=1S/C23H18N2O3/c26-22-19(13-10-16-7-4-14-24-21(16)22)20(15-5-2-1-3-6-15)25-18-11-8-17(9-12-18)23(27)28/h1-14,20,25-26H,(H,27,28)
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n/an/a 6.90E+3n/an/an/an/an/an/a



New York University Abu Dhabi

Curated by ChEMBL


Assay Description
Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnesyl)QIIM and ABZ-KSKTKC(farnesyl)VIQI as substrate assessed as residua...

Bioorg Med Chem 24: 160-78 (2016)


Article DOI: 10.1016/j.bmc.2015.11.043
BindingDB Entry DOI: 10.7270/Q2NS0XXQ
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50096861
PNG
(CHEMBL440905 | Heptadecanoic acid {[3-(2,3-dimethy...)
Show SMILES CCCCCCCCCCCCCCCCC(=O)NCC(=O)Nc1cccc(c1)S(=O)(=O)Nc1cccc(C)c1C
Show InChI InChI=1S/C33H51N3O4S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-32(37)34-26-33(38)35-29-21-19-22-30(25-29)41(39,40)36-31-23-18-20-27(2)28(31)3/h18-23,25,36H,4-17,24,26H2,1-3H3,(H,34,37)(H,35,38)
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n/an/a 7.00E+3n/an/an/an/an/an/a



Philipps-Universität Marburg

Curated by ChEMBL


Assay Description
Inhibition of recombinant prenyl protein-specific protease Rce1 expressed in Sf9 cells at 10 uM

Bioorg Med Chem Lett 11: 425-7 (2001)


BindingDB Entry DOI: 10.7270/Q20G3JF1
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50096860
PNG
((E)-3-Biphenyl-4-yl-N-{2-[3-(2,3-dimethyl-phenylsu...)
Show SMILES Cc1cccc(NS(=O)(=O)c2cccc(NC(=O)CCNC(=O)\C=C\c3ccc(cc3)-c3ccccc3)c2)c1C
Show InChI InChI=1S/C32H31N3O4S/c1-23-8-6-13-30(24(23)2)35-40(38,39)29-12-7-11-28(22-29)34-32(37)20-21-33-31(36)19-16-25-14-17-27(18-15-25)26-9-4-3-5-10-26/h3-19,22,35H,20-21H2,1-2H3,(H,33,36)(H,34,37)/b19-16+
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n/an/a 7.00E+3n/an/an/an/an/an/a



Philipps-Universität Marburg

Curated by ChEMBL


Assay Description
Inhibition of recombinant prenyl protein-specific protease Rce1 expressed in Sf9 cells at 10 uM

Bioorg Med Chem Lett 11: 425-7 (2001)


BindingDB Entry DOI: 10.7270/Q20G3JF1
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50500091
PNG
(CHEMBL3740563)
Show SMILES Cc1ccc(cc1)C(Nc1ccc(cc1)C(O)=O)c1ccc2cccnc2c1O
Show InChI InChI=1S/C24H20N2O3/c1-15-4-6-17(7-5-15)21(26-19-11-8-18(9-12-19)24(28)29)20-13-10-16-3-2-14-25-22(16)23(20)27/h2-14,21,26-27H,1H3,(H,28,29)
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n/an/a 7.10E+3n/an/an/an/an/an/a



New York University Abu Dhabi

Curated by ChEMBL


Assay Description
Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnesyl)QIIM and ABZ-KSKTKC(farnesyl)VIQI as substrate assessed as residua...

Bioorg Med Chem 24: 160-78 (2016)


Article DOI: 10.1016/j.bmc.2015.11.043
BindingDB Entry DOI: 10.7270/Q2NS0XXQ
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50480670
PNG
(CHEMBL553161)
Show SMILES [H][C@@]12CC[C@]3(C)[C@]([H])(C[C@H](OC(=O)CC(O)CC)[C@]4(C)C5=C([C@@H](C[C@@]34[H])OCC)C(C)(O)OC5=O)[C@@]1(C)CCC[C@]2(C)CC |r,c:20|
Show InChI InChI=1S/C34H54O7/c1-9-20(35)17-26(36)40-25-19-23-31(5)15-12-14-30(4,10-2)22(31)13-16-32(23,6)24-18-21(39-11-3)27-28(33(24,25)7)29(37)41-34(27,8)38/h20-25,35,38H,9-19H2,1-8H3/t20?,21-,22+,23-,24+,25+,30+,31+,32-,33-,34?/m1/s1
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n/an/a 7.30E+3n/an/an/an/an/an/a



University of British Columbia

Curated by ChEMBL


Assay Description
Inhibition of human RCE1

J Nat Prod 72: 1106-9 (2009)


Article DOI: 10.1021/np900042r
BindingDB Entry DOI: 10.7270/Q2930X0M
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50500100
PNG
(CHEMBL3740034)
Show SMILES OC(=O)c1ccc(NC(c2ccc(F)cc2)c2ccc3cccnc3c2O)cc1
Show InChI InChI=1S/C23H17FN2O3/c24-17-8-3-15(4-9-17)20(26-18-10-5-16(6-11-18)23(28)29)19-12-7-14-2-1-13-25-21(14)22(19)27/h1-13,20,26-27H,(H,28,29)
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n/an/a 8.20E+3n/an/an/an/an/an/a



New York University Abu Dhabi

Curated by ChEMBL


Assay Description
Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnesyl)QIIM and ABZ-KSKTKC(farnesyl)VIQI as substrate assessed as residua...

Bioorg Med Chem 24: 160-78 (2016)


Article DOI: 10.1016/j.bmc.2015.11.043
BindingDB Entry DOI: 10.7270/Q2NS0XXQ
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50500095
PNG
(CHEMBL2003928)
Show SMILES Cc1ccc(NC(c2ccccc2)c2ccc3cccnc3c2O)cc1
Show InChI InChI=1S/C23H20N2O/c1-16-9-12-19(13-10-16)25-21(17-6-3-2-4-7-17)20-14-11-18-8-5-15-24-22(18)23(20)26/h2-15,21,25-26H,1H3
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n/an/a 8.80E+3n/an/an/an/an/an/a



New York University Abu Dhabi

Curated by ChEMBL


Assay Description
Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnesyl)QIIM and ABZ-KSKTKC(farnesyl)VIQI as substrate assessed as residua...

Bioorg Med Chem 24: 160-78 (2016)


Article DOI: 10.1016/j.bmc.2015.11.043
BindingDB Entry DOI: 10.7270/Q2NS0XXQ
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50500107
PNG
(CHEMBL3741464)
Show SMILES Oc1c(ccc2cccnc12)C(Nc1ccccc1)c1ccccc1
Show InChI InChI=1S/C22H18N2O/c25-22-19(14-13-17-10-7-15-23-21(17)22)20(16-8-3-1-4-9-16)24-18-11-5-2-6-12-18/h1-15,20,24-25H
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n/an/a 8.90E+3n/an/an/an/an/an/a



New York University Abu Dhabi

Curated by ChEMBL


Assay Description
Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnesyl)QIIM and ABZ-KSKTKC(farnesyl)VIQI as substrate assessed as residua...

Bioorg Med Chem 24: 160-78 (2016)


Article DOI: 10.1016/j.bmc.2015.11.043
BindingDB Entry DOI: 10.7270/Q2NS0XXQ
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50500102
PNG
(CHEMBL3740606)
Show SMILES Oc1c(ccc2ccccc12)C(Nc1ccccc1)c1c(F)cc(Br)cc1F
Show InChI InChI=1S/C23H16BrF2NO/c24-15-12-19(25)21(20(26)13-15)22(27-16-7-2-1-3-8-16)18-11-10-14-6-4-5-9-17(14)23(18)28/h1-13,22,27-28H
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n/an/a 9.40E+3n/an/an/an/an/an/a



New York University Abu Dhabi

Curated by ChEMBL


Assay Description
Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnesyl)QIIM and ABZ-KSKTKC(farnesyl)VIQI as substrate assessed as residua...

Bioorg Med Chem 24: 160-78 (2016)


Article DOI: 10.1016/j.bmc.2015.11.043
BindingDB Entry DOI: 10.7270/Q2NS0XXQ
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50500109
PNG
(CHEMBL3740547)
Show SMILES OC(=O)c1ccc(NC(C2CCCCC2)c2ccc3cccnc3c2O)cc1
Show InChI InChI=1S/C23H24N2O3/c26-22-19(13-10-16-7-4-14-24-21(16)22)20(15-5-2-1-3-6-15)25-18-11-8-17(9-12-18)23(27)28/h4,7-15,20,25-26H,1-3,5-6H2,(H,27,28)
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n/an/a 9.80E+3n/an/an/an/an/an/a



New York University Abu Dhabi

Curated by ChEMBL


Assay Description
Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnesyl)QIIM and ABZ-KSKTKC(farnesyl)VIQI as substrate assessed as residua...

Bioorg Med Chem 24: 160-78 (2016)


Article DOI: 10.1016/j.bmc.2015.11.043
BindingDB Entry DOI: 10.7270/Q2NS0XXQ
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50500093
PNG
(CHEMBL2006267)
Show SMILES Oc1c(ccc2cccnc12)C(Nc1ccccc1)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C22H17N3O3/c26-22-19(13-10-15-5-4-14-23-21(15)22)20(24-17-6-2-1-3-7-17)16-8-11-18(12-9-16)25(27)28/h1-14,20,24,26H
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n/an/a 1.10E+4n/an/an/an/an/an/a



New York University Abu Dhabi

Curated by ChEMBL


Assay Description
Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnesyl)QIIM and ABZ-KSKTKC(farnesyl)VIQI as substrate assessed as residua...

Bioorg Med Chem 24: 160-78 (2016)


Article DOI: 10.1016/j.bmc.2015.11.043
BindingDB Entry DOI: 10.7270/Q2NS0XXQ
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50096862
PNG
((9Z,12Z)-Octadeca-9,12-dienoic acid {2-[3-(2,3-dim...)
Show SMILES CCCCC\C=C/C\C=C/CCCCCCCC(=O)NCCC(=O)Nc1cccc(c1)S(=O)(=O)Nc1cccc(C)c1C
Show InChI InChI=1S/C35H51N3O4S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25-34(39)36-27-26-35(40)37-31-22-20-23-32(28-31)43(41,42)38-33-24-19-21-29(2)30(33)3/h8-9,11-12,19-24,28,38H,4-7,10,13-18,25-27H2,1-3H3,(H,36,39)(H,37,40)/b9-8-,12-11-
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n/an/a 1.40E+4n/an/an/an/an/an/a



Philipps-Universität Marburg

Curated by ChEMBL


Assay Description
Inhibition of recombinant prenyl protein-specific protease Rcel expressed in Sf9 cells

Bioorg Med Chem Lett 11: 425-7 (2001)


BindingDB Entry DOI: 10.7270/Q20G3JF1
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50500096
PNG
(CHEMBL3739720)
Show SMILES OC(=O)c1ccc(NC(c2cccnc2)c2ccc3cccnc3c2O)cc1
Show InChI InChI=1S/C22H17N3O3/c26-21-18(10-7-14-3-2-12-24-20(14)21)19(16-4-1-11-23-13-16)25-17-8-5-15(6-9-17)22(27)28/h1-13,19,25-26H,(H,27,28)
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n/an/a 1.40E+4n/an/an/an/an/an/a



New York University Abu Dhabi

Curated by ChEMBL


Assay Description
Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnesyl)QIIM and ABZ-KSKTKC(farnesyl)VIQI as substrate assessed as residua...

Bioorg Med Chem 24: 160-78 (2016)


Article DOI: 10.1016/j.bmc.2015.11.043
BindingDB Entry DOI: 10.7270/Q2NS0XXQ
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50500108
PNG
(CHEMBL3740917)
Show SMILES OC(=O)c1ccc(NC(c2ccc(cc2)C#N)c2ccc3cccnc3c2O)cc1
Show InChI InChI=1S/C24H17N3O3/c25-14-15-3-5-17(6-4-15)21(27-19-10-7-18(8-11-19)24(29)30)20-12-9-16-2-1-13-26-22(16)23(20)28/h1-13,21,27-28H,(H,29,30)
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n/an/a 1.60E+4n/an/an/an/an/an/a



New York University Abu Dhabi

Curated by ChEMBL


Assay Description
Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnesyl)QIIM and ABZ-KSKTKC(farnesyl)VIQI as substrate assessed as residua...

Bioorg Med Chem 24: 160-78 (2016)


Article DOI: 10.1016/j.bmc.2015.11.043
BindingDB Entry DOI: 10.7270/Q2NS0XXQ
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50480671
PNG
(CHEMBL555914)
Show SMILES [H][C@@]12CC[C@]3(C)[C@]([H])(C[C@H](OC(=O)CC(O)CC)[C@]4(C)C5=C(C=C[C@@]34[H])C(C)(O)OC5=O)[C@@]1(C)CCC[C@]2(C)CC |r,c:20,22|
Show InChI InChI=1S/C32H48O6/c1-8-19(33)17-25(34)37-24-18-23-29(4)15-10-14-28(3,9-2)21(29)13-16-30(23,5)22-12-11-20-26(31(22,24)6)27(35)38-32(20,7)36/h11-12,19,21-24,33,36H,8-10,13-18H2,1-7H3/t19?,21-,22-,23+,24-,28-,29-,30-,31+,32?/m0/s1
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n/an/a 1.70E+4n/an/an/an/an/an/a



University of British Columbia

Curated by ChEMBL


Assay Description
Inhibition of human RCE1

J Nat Prod 72: 1106-9 (2009)


Article DOI: 10.1021/np900042r
BindingDB Entry DOI: 10.7270/Q2930X0M
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50500104
PNG
(CHEMBL3739592)
Show SMILES OC(=O)c1ccc(NC(c2ccccn2)c2ccc3cccnc3c2O)cc1
Show InChI InChI=1S/C22H17N3O3/c26-21-17(11-8-14-4-3-13-24-19(14)21)20(18-5-1-2-12-23-18)25-16-9-6-15(7-10-16)22(27)28/h1-13,20,25-26H,(H,27,28)
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n/an/a 3.80E+4n/an/an/an/an/an/a



New York University Abu Dhabi

Curated by ChEMBL


Assay Description
Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnesyl)QIIM and ABZ-KSKTKC(farnesyl)VIQI as substrate assessed as residua...

Bioorg Med Chem 24: 160-78 (2016)


Article DOI: 10.1016/j.bmc.2015.11.043
BindingDB Entry DOI: 10.7270/Q2NS0XXQ
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50480672
PNG
(CHEMBL561185)
Show SMILES [H][C@@]12CC[C@]3(C)[C@]([H])(C[C@H](OC(=O)CC(O)C(C)C)[C@]4(C)C=C([C@H](O)C[C@@]34[H])C(C)=O)[C@@]1(C)CCC[C@]2(C)CC |r,c:21|
Show InChI InChI=1S/C32H52O5/c1-9-29(5)12-10-13-30(6)24(29)11-14-31(7)25-15-23(35)21(20(4)33)18-32(25,8)27(17-26(30)31)37-28(36)16-22(34)19(2)3/h18-19,22-27,34-35H,9-17H2,1-8H3/t22?,23-,24+,25+,26-,27+,29+,30+,31+,32-/m1/s1
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n/an/a 7.35E+4n/an/an/an/an/an/a



University of British Columbia

Curated by ChEMBL


Assay Description
Inhibition of human RCE1

J Nat Prod 72: 1106-9 (2009)


Article DOI: 10.1021/np900042r
BindingDB Entry DOI: 10.7270/Q2930X0M
More data for this
Ligand-Target Pair
CAAX prenyl protease 2


(Homo sapiens (Human))		BDBM50480669
PNG
(CHEMBL558514)
Show SMILES [H][C@@]12CC[C@]3(C)[C@]([H])(C[C@H](OC(=O)CC(O)CC)[C@]4(C)C=C([C@H](O)C[C@@]34[H])C(C)=O)[C@@]1(C)CCC[C@]2(C)CC |r,c:20|
Show InChI InChI=1S/C31H50O5/c1-8-20(33)15-27(35)36-26-17-25-29(5)13-10-12-28(4,9-2)23(29)11-14-30(25,6)24-16-22(34)21(19(3)32)18-31(24,26)7/h18,20,22-26,33-34H,8-17H2,1-7H3/t20?,22-,23+,24+,25-,26+,28+,29+,30+,31-/m1/s1
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n/an/a>1.98E+5n/an/an/an/an/an/a



University of British Columbia

Curated by ChEMBL


Assay Description
Inhibition of human RCE1

J Nat Prod 72: 1106-9 (2009)


Article DOI: 10.1021/np900042r
BindingDB Entry DOI: 10.7270/Q2930X0M
More data for this
Ligand-Target Pair