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PubChem AID 651672

Compile Data Set for Download or QSAR

Found 234 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Perilipin-1


(Homo sapiens (Human))
BDBM72328
PNG
((Z)-3-(4-chlorophenyl)-2-(4-keto-5,6-dimethyl-3H-t...)
Show SMILES CCOC(=O)C(=Cc1ccc(Cl)cc1)c1nc2sc(C)c(C)c2c(=O)[nH]1 |w:6.6|
Show InChI InChI=1S/C19H17ClN2O3S/c1-4-25-19(24)14(9-12-5-7-13(20)8-6-12)16-21-17(23)15-10(2)11(3)26-18(15)22-16/h5-9H,4H2,1-3H3,(H,21,22,23)/b14-9-
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n/an/a 525n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94642
PNG
(MLS002639224 | SMR001548671 | cid_231714)
Show SMILES CC(=O)Oc1ccc(cc1)C12c3ccccc3C1(OC(C)=O)c1cc(OC(C)=O)ccc21
Show InChI InChI=1S/C26H20O6/c1-15(27)30-19-10-8-18(9-11-19)25-21-6-4-5-7-23(21)26(25,32-17(3)29)24-14-20(31-16(2)28)12-13-22(24)25/h4-14H,1-3H3
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n/an/a 581n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM47853
PNG
(2-furancarboxylic acid [4-bromo-2-[(E)-3-(4-methyl...)
Show SMILES Cc1ccc(\C=C\C(=O)c2cc(Br)ccc2OC(=O)c2ccco2)cc1
Show InChI InChI=1S/C21H15BrO4/c1-14-4-6-15(7-5-14)8-10-18(23)17-13-16(22)9-11-19(17)26-21(24)20-3-2-12-25-20/h2-13H,1H3/b10-8+
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n/an/a 684n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM49749
PNG
(7-methyl-1,3-dinitro-acridine | 7-methyl-1,3-dinit...)
Show SMILES Cc1ccc2nc3cc(cc([N+]([O-])=O)c3cc2c1)[N+]([O-])=O
Show InChI InChI=1S/C14H9N3O4/c1-8-2-3-12-9(4-8)5-11-13(15-12)6-10(16(18)19)7-14(11)17(20)21/h2-7H,1H3
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n/an/a 801n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM43422
PNG
((E)-2-cyano-3-[3-[(E)-2-cyano-3-(2-methoxyethylami...)
Show SMILES COCCNC(=O)C(=C\c1cccc(\C=C(/C#N)C(=O)NCCOC)c1)\C#N
Show InChI InChI=1S/C20H22N4O4/c1-27-8-6-23-19(25)17(13-21)11-15-4-3-5-16(10-15)12-18(14-22)20(26)24-7-9-28-2/h3-5,10-12H,6-9H2,1-2H3,(H,23,25)(H,24,26)/b17-11+,18-12+
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n/an/a 804n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM78081
PNG
((E)-6,6,7,7-tetrafluoro-5-hydroxy-1,5-diphenyl-1-h...)
Show SMILES OC(CC(=O)C=Cc1ccccc1)(c1ccccc1)C(F)(F)C(F)F |w:5.4|
Show InChI InChI=1S/C19H16F4O2/c20-17(21)19(22,23)18(25,15-9-5-2-6-10-15)13-16(24)12-11-14-7-3-1-4-8-14/h1-12,17,25H,13H2
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n/an/a 821n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94560
PNG
(MLS003674207 | N-cyclohexyl-2-[3-(2-furanyl)-2-oxo...)
Show SMILES O=C(NC1CCCCC1)C(c1ccccc1)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C26H25N3O3/c30-25(27-19-12-5-2-6-13-19)24(18-10-3-1-4-11-18)29-21-15-8-7-14-20(21)28-23(26(29)31)22-16-9-17-32-22/h1,3-4,7-11,14-17,19,24H,2,5-6,12-13H2,(H,27,30)
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n/an/a 964n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94538
PNG
(2-[phenyl(1-piperidinyl)methyl]-1-naphthalenol | 2...)
Show SMILES Oc1c(ccc2ccccc12)C(N1CCCCC1)c1ccccc1
Show InChI InChI=1S/C22H23NO/c24-22-19-12-6-5-9-17(19)13-14-20(22)21(18-10-3-1-4-11-18)23-15-7-2-8-16-23/h1,3-6,9-14,21,24H,2,7-8,15-16H2
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n/an/a 1.01E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94633
PNG
(2-[4-(1,3-benzodioxol-5-yl)-2-ethyl-2-methyl-5,6-d...)
Show SMILES CCC1(C)NC(CC(=N1)c1ccc2OCOc2c1)c1ccccc1O |c:7|
Show InChI InChI=1S/C20H22N2O3/c1-3-20(2)21-15(13-8-9-18-19(10-13)25-12-24-18)11-16(22-20)14-6-4-5-7-17(14)23/h4-10,16,22-23H,3,11-12H2,1-2H3
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n/an/a 1.06E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94561
PNG
(2-(2-fluorophenyl)-2-[3-(2-furanyl)-2-oxo-1-quinox...)
Show SMILES CCCCCNC(=O)C(c1ccccc1F)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C25H24FN3O3/c1-2-3-8-15-27-24(30)23(17-10-4-5-11-18(17)26)29-20-13-7-6-12-19(20)28-22(25(29)31)21-14-9-16-32-21/h4-7,9-14,16,23H,2-3,8,15H2,1H3,(H,27,30)
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n/an/a 1.09E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM58492
PNG
(2-[4-[(Z)-4-chloranyl-1,2-diphenyl-but-1-enyl]phen...)
Show SMILES CN(C)CCOc1ccc(cc1)C(=C(\CCCl)c1ccccc1)\c1ccccc1
Show InChI InChI=1S/C26H28ClNO/c1-28(2)19-20-29-24-15-13-23(14-16-24)26(22-11-7-4-8-12-22)25(17-18-27)21-9-5-3-6-10-21/h3-16H,17-20H2,1-2H3/b26-25-
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n/an/a 1.14E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM83461
PNG
((phenylmethyl) N,N-dimethyl-N'-(C-methylsulfanyl-N...)
Show SMILES CS\C(N=C(SCc1ccccc1)N(C)C)=N/c1ccccc1
Show InChI InChI=1S/C18H21N3S2/c1-21(2)18(23-14-15-10-6-4-7-11-15)20-17(22-3)19-16-12-8-5-9-13-16/h4-13H,14H2,1-3H3/b19-17-,20-18?
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n/an/a 1.18E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94514
PNG
(MLS003674206 | N-cyclohexyl-2-[3-(2-furanyl)-2-oxo...)
Show SMILES O=C(NC1CCCCC1)C(c1cccc2ccccc12)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C30H27N3O3/c34-29(31-21-12-2-1-3-13-21)28(23-15-8-11-20-10-4-5-14-22(20)23)33-25-17-7-6-16-24(25)32-27(30(33)35)26-18-9-19-36-26/h4-11,14-19,21,28H,1-3,12-13H2,(H,31,34)
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n/an/a 1.22E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM43818
PNG
((2Z)-3-ethyl-2-[(E)-3-(3-ethyl-5-phenyl-1,3-benzox...)
Show SMILES CCN1\C(Oc2ccc(cc12)-c1ccccc1)=C\C=C\c1oc2ccc(cc2[n+]1CC)-c1ccccc1
Show InChI InChI=1S/C33H29N2O2/c1-3-34-28-22-26(24-12-7-5-8-13-24)18-20-30(28)36-32(34)16-11-17-33-35(4-2)29-23-27(19-21-31(29)37-33)25-14-9-6-10-15-25/h5-23H,3-4H2,1-2H3/q+1
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n/an/a 1.25E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM88500
PNG
(3-hydroxybutanoic acid [(3aS,3bR,5aS,9aS,9bR,11aS)...)
Show SMILES CC(O)CC(=O)OC[C@]12CC[C@H]3[C@@](C)(CC[C@H]4C(C)(C)CCC[C@]34C)[C@@H]1CC(O2)C1=CC(=O)OC1O |t:33|
Show InChI InChI=1S/C29H44O7/c1-17(30)13-23(31)34-16-29-12-8-21-27(4)10-6-9-26(2,3)20(27)7-11-28(21,5)22(29)15-19(36-29)18-14-24(32)35-25(18)33/h14,17,19-22,25,30,33H,6-13,15-16H2,1-5H3/t17?,19?,20-,21+,22-,25?,27-,28+,29+/m0/s1
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n/an/a 1.25E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94629
PNG
(MLS003674203 | N-cyclohexyl-2-[3-(2-furanyl)-2-oxo...)
Show SMILES COc1ccc(cc1)C(C(=O)NC1CCCCC1)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C27H27N3O4/c1-33-20-15-13-18(14-16-20)25(26(31)28-19-8-3-2-4-9-19)30-22-11-6-5-10-21(22)29-24(27(30)32)23-12-7-17-34-23/h5-7,10-17,19,25H,2-4,8-9H2,1H3,(H,28,31)
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n/an/a 1.27E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94594
PNG
(2-(1-benzofuran-2-yl)-N-cyclohexyl-2-[3-(furan-2-y...)
Show SMILES O=C(NC1CCCCC1)C(c1cc2ccccc2o1)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C28H25N3O4/c32-27(29-19-10-2-1-3-11-19)26(24-17-18-9-4-7-14-22(18)35-24)31-21-13-6-5-12-20(21)30-25(28(31)33)23-15-8-16-34-23/h4-9,12-17,19,26H,1-3,10-11H2,(H,29,32)
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n/an/a 1.29E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM87845
PNG
(2-Butyl-thiazolidine-4-carboxylic acid | 2-butyl-1...)
Show SMILES CCCCC1NC(CS1)C(O)=O
Show InChI InChI=1S/C8H15NO2S/c1-2-3-4-7-9-6(5-12-7)8(10)11/h6-7,9H,2-5H2,1H3,(H,10,11)
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n/an/a 1.35E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94608
PNG
(2-heptylidene-5-(1-pyrrolidinylmethyl)-1-cyclopent...)
Show SMILES CCCCCCC=C1CCC(CN2CCCC2)C1=O |w:6.5|
Show InChI InChI=1S/C17H29NO/c1-2-3-4-5-6-9-15-10-11-16(17(15)19)14-18-12-7-8-13-18/h9,16H,2-8,10-14H2,1H3
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n/an/a 1.37E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94591
PNG
(MLS003674222 | N-tert-butyl-2-(4-cyanophenyl)-2-[3...)
Show SMILES CC(C)(C)NC(=O)C(c1ccc(cc1)C#N)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C25H22N4O3/c1-25(2,3)28-23(30)22(17-12-10-16(15-26)11-13-17)29-19-8-5-4-7-18(19)27-21(24(29)31)20-9-6-14-32-20/h4-14,22H,1-3H3,(H,28,30)
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n/an/a 1.41E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94508
PNG
(2-[3-(2-furanyl)-2-oxo-1-quinoxalinyl]-2-(4-methox...)
Show SMILES CCCCCNC(=O)C(c1ccc(OC)cc1)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C26H27N3O4/c1-3-4-7-16-27-25(30)24(18-12-14-19(32-2)15-13-18)29-21-10-6-5-9-20(21)28-23(26(29)31)22-11-8-17-33-22/h5-6,8-15,17,24H,3-4,7,16H2,1-2H3,(H,27,30)
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n/an/a 1.41E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94617
PNG
(MLS003674193 | N-(2,6-dimethylphenyl)-2-[3-(2-fura...)
Show SMILES Cc1cccc(C)c1NC(=O)C(c1ccc(cc1)-c1ccccc1)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C34H27N3O3/c1-22-10-8-11-23(2)30(22)36-33(38)32(26-19-17-25(18-20-26)24-12-4-3-5-13-24)37-28-15-7-6-14-27(28)35-31(34(37)39)29-16-9-21-40-29/h3-21,32H,1-2H3,(H,36,38)
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n/an/a 1.48E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94590
PNG
(2-(1-benzofuran-2-yl)-2-[3-(furan-2-yl)-2-oxidanyl...)
Show SMILES CCCCCNC(=O)C(c1cc2ccccc2o1)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C27H25N3O4/c1-2-3-8-15-28-26(31)25(23-17-18-10-4-7-13-21(18)34-23)30-20-12-6-5-11-19(20)29-24(27(30)32)22-14-9-16-33-22/h4-7,9-14,16-17,25H,2-3,8,15H2,1H3,(H,28,31)
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n/an/a 1.48E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94545
PNG
(2-[3-(2-furanyl)-2-oxo-1-quinoxalinyl]-N-(phenylme...)
Show SMILES FC(F)(F)c1ccc(cc1)C(C(=O)NCc1ccccc1)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C28H20F3N3O3/c29-28(30,31)20-14-12-19(13-15-20)25(26(35)32-17-18-7-2-1-3-8-18)34-22-10-5-4-9-21(22)33-24(27(34)36)23-11-6-16-37-23/h1-16,25H,17H2,(H,32,35)
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n/an/a 1.59E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM90719
PNG
(4-Bromo-benzoic acid 4-hydroxy-2-(2-oxo-propyl)-na...)
Show SMILES CC(=O)Cc1cc(O)c2ccccc2c1OC(=O)c1ccc(Br)cc1
Show InChI InChI=1S/C20H15BrO4/c1-12(22)10-14-11-18(23)16-4-2-3-5-17(16)19(14)25-20(24)13-6-8-15(21)9-7-13/h2-9,11,23H,10H2,1H3
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n/an/a 1.60E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94565
PNG
(MLS003674210 | N-cyclohexyl-2-[3-(2-furanyl)-2-oxo...)
Show SMILES FC(F)(F)c1ccc(cc1)C(C(=O)NC1CCCCC1)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C27H24F3N3O3/c28-27(29,30)18-14-12-17(13-15-18)24(25(34)31-19-7-2-1-3-8-19)33-21-10-5-4-9-20(21)32-23(26(33)35)22-11-6-16-36-22/h4-6,9-16,19,24H,1-3,7-8H2,(H,31,34)
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n/an/a 1.67E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94612
PNG
(MLS003674214 | N-tert-butyl-2-[3-(2-furanyl)-2-oxo...)
Show SMILES CC(C)(C)NC(=O)C(c1ccc(cc1)-c1ccccc1)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C30H27N3O3/c1-30(2,3)32-28(34)27(22-17-15-21(16-18-22)20-10-5-4-6-11-20)33-24-13-8-7-12-23(24)31-26(29(33)35)25-14-9-19-36-25/h4-19,27H,1-3H3,(H,32,34)
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n/an/a 1.67E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM70875
PNG
((Z)-2-(1,3-benzothiazol-2-yl)-N-(4-chlorophenyl)-3...)
Show SMILES Oc1cccc(\C=C(\C(=O)Nc2ccc(Cl)cc2)c2nc3ccccc3s2)c1
Show InChI InChI=1S/C22H15ClN2O2S/c23-15-8-10-16(11-9-15)24-21(27)18(13-14-4-3-5-17(26)12-14)22-25-19-6-1-2-7-20(19)28-22/h1-13,26H,(H,24,27)/b18-13-
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n/an/a 1.68E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94595
PNG
((5Z)-1-(4-fluorobenzyl)-5-[(E)-3-(2-furyl)prop-2-e...)
Show SMILES Fc1ccc(CN2C(=O)NC(=O)\C(=C\C=C\c3ccco3)C2=O)cc1
Show InChI InChI=1S/C18H13FN2O4/c19-13-8-6-12(7-9-13)11-21-17(23)15(16(22)20-18(21)24)5-1-3-14-4-2-10-25-14/h1-10H,11H2,(H,20,22,24)/b3-1+,15-5-
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n/an/a 1.69E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94585
PNG
(2-(4-cyanophenyl)-2-[3-(2-furanyl)-2-oxo-1-quinoxa...)
Show SMILES O=C(NCc1ccccc1)C(c1ccc(cc1)C#N)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C28H20N4O3/c29-17-19-12-14-21(15-13-19)26(27(33)30-18-20-7-2-1-3-8-20)32-23-10-5-4-9-22(23)31-25(28(32)34)24-11-6-16-35-24/h1-16,26H,18H2,(H,30,33)
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n/an/a 1.70E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM66855
PNG
(5-chloranyl-2-[(4-methylphenyl)methylsulfonyl]-N-(...)
Show SMILES CC(C)c1nnc(NC(=O)c2nc(ncc2Cl)S(=O)(=O)Cc2ccc(C)cc2)s1
Show InChI InChI=1S/C18H18ClN5O3S2/c1-10(2)16-23-24-17(28-16)22-15(25)14-13(19)8-20-18(21-14)29(26,27)9-12-6-4-11(3)5-7-12/h4-8,10H,9H2,1-3H3,(H,22,24,25)
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n/an/a 1.71E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM48194
PNG
((2,2,4-trimethyl-1H-quinolin-6-yl) 2-(2,5-dioxopyr...)
Show SMILES CC1=CC(C)(C)Nc2ccc(OC(=O)CN3C(=O)CCC3=O)cc12 |t:1|
Show InChI InChI=1S/C18H20N2O4/c1-11-9-18(2,3)19-14-5-4-12(8-13(11)14)24-17(23)10-20-15(21)6-7-16(20)22/h4-5,8-9,19H,6-7,10H2,1-3H3
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n/an/a 1.72E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM34962
PNG
(5-hydroxy-4-[[4-(2-hydroxyethyl)-1-piperazinyl]met...)
Show SMILES CCOC(=O)c1c(C)oc2c1c(CN1CCN(CCO)CC1)c(O)c1ccccc21
Show InChI InChI=1S/C23H28N2O5/c1-3-29-23(28)19-15(2)30-22-17-7-5-4-6-16(17)21(27)18(20(19)22)14-25-10-8-24(9-11-25)12-13-26/h4-7,26-27H,3,8-14H2,1-2H3
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n/an/a 1.81E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94558
PNG
(MLS003674213 | N-tert-butyl-2-[3-(2-furanyl)-2-oxo...)
Show SMILES COc1ccc(cc1)C(C(=O)NC(C)(C)C)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C25H25N3O4/c1-25(2,3)27-23(29)22(16-11-13-17(31-4)14-12-16)28-19-9-6-5-8-18(19)26-21(24(28)30)20-10-7-15-32-20/h5-15,22H,1-4H3,(H,27,29)
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n/an/a 1.82E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94553
PNG
((2,2,4-trimethyl-1H-quinolin-6-yl) 2-(1,3-dioxoiso...)
Show SMILES CC(N1C(=O)c2ccccc2C1=O)C(=O)Oc1ccc2NC(C)(C)C=C(C)c2c1 |t:26|
Show InChI InChI=1S/C23H22N2O4/c1-13-12-23(3,4)24-19-10-9-15(11-18(13)19)29-22(28)14(2)25-20(26)16-7-5-6-8-17(16)21(25)27/h5-12,14,24H,1-4H3
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n/an/a 1.82E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM83788
PNG
((5Z)-1-benzyl-5-[(E)-3-(2-furyl)prop-2-enylidene]b...)
Show SMILES O=C1NC(=O)\C(=C\C=C\c2ccco2)C(=O)N1Cc1ccccc1
Show InChI InChI=1S/C18H14N2O4/c21-16-15(10-4-8-14-9-5-11-24-14)17(22)20(18(23)19-16)12-13-6-2-1-3-7-13/h1-11H,12H2,(H,19,21,23)/b8-4+,15-10-
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n/an/a 1.82E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94507
PNG
(2-[2-(diethylamino)ethoxy]ethyl 1-phenylcyclopenta...)
Show SMILES CCN(CC)CCOCCOC(=O)C1(CCCC1)c1ccccc1
Show InChI InChI=1S/C20H31NO3/c1-3-21(4-2)14-15-23-16-17-24-19(22)20(12-8-9-13-20)18-10-6-5-7-11-18/h5-7,10-11H,3-4,8-9,12-17H2,1-2H3
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n/an/a 1.87E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94574
PNG
(MLS002699028 | SMR001563150 | [(1R,2S,4E,8Z,12S,13...)
Show SMILES CC(=O)O[C@H]1C\C(C)=C\CC\C(C)=C/CC[C@](C)(O)[C@@H]2C[C@@H]1C(=C)C(=O)O2 |c:12,t:7|
Show InChI InChI=1S/C22H32O5/c1-14-8-6-9-15(2)12-19(26-17(4)23)18-13-20(27-21(24)16(18)3)22(5,25)11-7-10-14/h9-10,18-20,25H,3,6-8,11-13H2,1-2,4-5H3/b14-10-,15-9+/t18-,19+,20+,22+/m1/s1
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n/an/a 1.87E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94562
PNG
(MLS003674192 | N-(2,6-dimethylphenyl)-2-[3-(2-fura...)
Show SMILES COc1ccc(cc1)C(C(=O)Nc1c(C)cccc1C)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C29H25N3O4/c1-18-8-6-9-19(2)25(18)31-28(33)27(20-13-15-21(35-3)16-14-20)32-23-11-5-4-10-22(23)30-26(29(32)34)24-12-7-17-36-24/h4-17,27H,1-3H3,(H,31,33)
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n/an/a 1.88E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94544
PNG
(MLS003674204 | N-cyclohexyl-2-[3-(2-furanyl)-2-oxo...)
Show SMILES O=C(NC1CCCCC1)C(c1ccc(cc1)-c1ccccc1)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C32H29N3O3/c36-31(33-25-12-5-2-6-13-25)30(24-19-17-23(18-20-24)22-10-3-1-4-11-22)35-27-15-8-7-14-26(27)34-29(32(35)37)28-16-9-21-38-28/h1,3-4,7-11,14-21,25,30H,2,5-6,12-13H2,(H,33,36)
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n/an/a 1.88E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94506
PNG
(MLS003674209 | N-cyclohexyl-2-(2-fluorophenyl)-2-[...)
Show SMILES Fc1ccccc1C(C(=O)NC1CCCCC1)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C26H24FN3O3/c27-19-12-5-4-11-18(19)24(25(31)28-17-9-2-1-3-10-17)30-21-14-7-6-13-20(21)29-23(26(30)32)22-15-8-16-33-22/h4-8,11-17,24H,1-3,9-10H2,(H,28,31)
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n/an/a 1.90E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM79210
PNG
((1S,5R)-3-(6,11-dihydro-5H-dibenzo[1,2-a:1',2'-e][...)
Show SMILES CN1[C@H]2CC[C@@H]1CC(C2)OC1c2ccccc2CCc2ccccc12
Show InChI InChI=1S/C23H27NO/c1-24-18-12-13-19(24)15-20(14-18)25-23-21-8-4-2-6-16(21)10-11-17-7-3-5-9-22(17)23/h2-9,18-20,23H,10-15H2,1H3/t18-,19+,20?
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n/an/a 1.92E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94615
PNG
(2-(4-cyanophenyl)-N-cyclohexyl-2-[3-(2-furanyl)-2-...)
Show SMILES O=C(NC1CCCCC1)C(c1ccc(cc1)C#N)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C27H24N4O3/c28-17-18-12-14-19(15-13-18)25(26(32)29-20-7-2-1-3-8-20)31-22-10-5-4-9-21(22)30-24(27(31)33)23-11-6-16-34-23/h4-6,9-16,20,25H,1-3,7-8H2,(H,29,32)
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n/an/a 1.92E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM50470
PNG
(2-[[5,6-bis(2-furanyl)-1,2,4-triazin-3-yl]thio]-N-...)
Show SMILES Cc1cccc(NC(=O)CSc2nnc(-c3ccco3)c(n2)-c2ccco2)c1
Show InChI InChI=1S/C20H16N4O3S/c1-13-5-2-6-14(11-13)21-17(25)12-28-20-22-18(15-7-3-9-26-15)19(23-24-20)16-8-4-10-27-16/h2-11H,12H2,1H3,(H,21,25)
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n/an/a 1.92E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94527
PNG
(2-(1-benzofuran-2-yl)-N-tert-butyl-2-[3-(furan-2-y...)
Show SMILES CC(C)(C)NC(=O)C(c1cc2ccccc2o1)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C26H23N3O4/c1-26(2,3)28-24(30)23(21-15-16-9-4-7-12-19(16)33-21)29-18-11-6-5-10-17(18)27-22(25(29)31)20-13-8-14-32-20/h4-15,23H,1-3H3,(H,28,30)
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n/an/a 1.93E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM37234
PNG
((2,2,4-trimethyl-1H-quinolin-6-yl) pyridine-3-carb...)
Show SMILES CC1=CC(C)(C)Nc2ccc(OC(=O)c3cccnc3)cc12 |t:1|
Show InChI InChI=1S/C18H18N2O2/c1-12-10-18(2,3)20-16-7-6-14(9-15(12)16)22-17(21)13-5-4-8-19-11-13/h4-11,20H,1-3H3
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n/an/a 1.93E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94630
PNG
(4-Amino-5-chloro-2-ethoxy-N-[4-(4-fluoro-benzyl)-m...)
Show SMILES CCOc1cc(N)c(Cl)cc1C(=O)NCC1CN(Cc2ccc(F)cc2)CCO1
Show InChI InChI=1S/C21H25ClFN3O3/c1-2-28-20-10-19(24)18(22)9-17(20)21(27)25-11-16-13-26(7-8-29-16)12-14-3-5-15(23)6-4-14/h3-6,9-10,16H,2,7-8,11-13,24H2,1H3,(H,25,27)
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MCE
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n/an/a 1.97E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM49500
PNG
(MLS000324854 | N-(3-cinnamoylphenyl)propanamide | ...)
Show SMILES CCC(=O)Nc1cccc(c1)C(=O)\C=C\c1ccccc1
Show InChI InChI=1S/C18H17NO2/c1-2-18(21)19-16-10-6-9-15(13-16)17(20)12-11-14-7-4-3-5-8-14/h3-13H,2H2,1H3,(H,19,21)/b12-11+
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n/an/a 1.99E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94551
PNG
(2-[3-(2-furanyl)-2-oxo-1-quinoxalinyl]-2-(1-naphth...)
Show SMILES CCCCCNC(=O)C(c1cccc2ccccc12)n1c2ccccc2nc(-c2ccco2)c1=O
Show InChI InChI=1S/C29H27N3O3/c1-2-3-8-18-30-28(33)27(22-14-9-12-20-11-4-5-13-21(20)22)32-24-16-7-6-15-23(24)31-26(29(32)34)25-17-10-19-35-25/h4-7,9-17,19,27H,2-3,8,18H2,1H3,(H,30,33)
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n/an/a 2.01E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Perilipin-1


(Homo sapiens (Human))
BDBM94502
PNG
(3-[6-[(2-chlorobenzyl)amino]-[1,2,4]triazolo[4,3-b...)
Show SMILES CC(CCc1ccco1)NC(=O)CCc1nnc2ccc(NCc3ccccc3Cl)nn12
Show InChI InChI=1S/C23H25ClN6O2/c1-16(8-9-18-6-4-14-32-18)26-23(31)13-12-22-28-27-21-11-10-20(29-30(21)22)25-15-17-5-2-3-7-19(17)24/h2-7,10-11,14,16H,8-9,12-13,15H2,1H3,(H,25,29)(H,26,31)
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n/an/a 2.03E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Displayed 1 to 50 (of 234 total )  |  Next  |  Last  >>
* indicates data uncertainty>20%