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Compile Data Set for Download or QSAR

Found 270 hits Enz. Inhib. hit(s) with Target = 'matrix metalloproteinase 1' AND taxid = 9606   
Target
(Institution)
LigandTarget
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
matrix metalloproteinase 1


(Homo sapiens)
BDBM48106
PNG
(3-(5-p-cumenyltetrazol-2-yl)propionic acid methyl ...)
Show SMILES COC(=O)CCn1nnc(n1)-c1ccc(cc1)C(C)C
Show InChI InChI=1S/C14H18N4O2/c1-10(2)11-4-6-12(7-5-11)14-15-17-18(16-14)9-8-13(19)20-3/h4-7,10H,8-9H2,1-3H3
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n/an/an/an/a 110n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48107
PNG
(2-Butyryl-3-(2,4-dimethoxy-phenylamino)-5,5-dimeth...)
Show SMILES CCCC(=O)C1=C(CC(C)(C)CC1=O)Nc1ccc(OC)cc1OC
Show InChI InChI=1S/C20H27NO4/c1-6-7-16(22)19-15(11-20(2,3)12-17(19)23)21-14-9-8-13(24-4)10-18(14)25-5/h8-10,21H,6-7,11-12H2,1-5H3
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n/an/an/an/a 2.36E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48108
PNG
((4-acetamidophenyl) piperidine-1-carboxylate | 1-p...)
Show SMILES CC(=O)Nc1ccc(OC(=O)N2CCCCC2)cc1
Show InChI InChI=1S/C14H18N2O3/c1-11(17)15-12-5-7-13(8-6-12)19-14(18)16-9-3-2-4-10-16/h5-8H,2-4,9-10H2,1H3,(H,15,17)
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n/an/an/an/a 5.00E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM31999
PNG
(3-[5-(4-Ethyl-phenyl)-tetrazol-2-yl]-propionic aci...)
Show SMILES CCc1ccc(cc1)-c1nnn(CCC(=O)OC)n1
Show InChI InChI=1S/C13H16N4O2/c1-3-10-4-6-11(7-5-10)13-14-16-17(15-13)9-8-12(18)19-2/h4-7H,3,8-9H2,1-2H3
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n/an/an/an/a 2.02E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48109
PNG
(3-(5-Benzo[1,3]dioxol-5-yl-[1,3,4]oxadiazol-2-ylsu...)
Show SMILES OC(=O)CCSc1nnc(o1)-c1ccc2OCOc2c1
Show InChI InChI=1S/C12H10N2O5S/c15-10(16)3-4-20-12-14-13-11(19-12)7-1-2-8-9(5-7)18-6-17-8/h1-2,5H,3-4,6H2,(H,15,16)
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n/an/an/an/a 2.97E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48110
PNG
(MLS000035103 | N-[6-(2-methylpropanoylamino)pyridi...)
Show SMILES CC(C)C(=O)Nc1ccc(NC(=O)c2ccccn2)cn1
Show InChI InChI=1S/C15H16N4O2/c1-10(2)14(20)19-13-7-6-11(9-17-13)18-15(21)12-5-3-4-8-16-12/h3-10H,1-2H3,(H,18,21)(H,17,19,20)
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n/an/an/an/a 6.27E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48111
PNG
(2-(4-Fluoro-phenyl)-5,6,7,8-tetrahydro-pyrazolo[5,...)
Show SMILES Fc1ccc(cc1)-c1cc2nc3CCCCc3c(=O)n2[nH]1
Show InChI InChI=1S/C16H14FN3O/c17-11-7-5-10(6-8-11)14-9-15-18-13-4-2-1-3-12(13)16(21)20(15)19-14/h5-9,19H,1-4H2
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n/an/an/an/a 6.48E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48112
PNG
(3-(5-p-cumenyltetrazol-2-yl)propionic acid | 3-[5-...)
Show SMILES CC(C)c1ccc(cc1)-c1nnn(CCC(O)=O)n1
Show InChI InChI=1S/C13H16N4O2/c1-9(2)10-3-5-11(6-4-10)13-14-16-17(15-13)8-7-12(18)19/h3-6,9H,7-8H2,1-2H3,(H,18,19)
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n/an/an/an/a 1.04E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM39086
PNG
(5-(4-Ethoxy-phenoxymethyl)-furan-2-carboxylic acid...)
Show SMILES CCOc1ccc(OCc2ccc(o2)C(=O)OCc2ccccn2)cc1
Show InChI InChI=1S/C20H19NO5/c1-2-23-16-6-8-17(9-7-16)24-14-18-10-11-19(26-18)20(22)25-13-15-5-3-4-12-21-15/h3-12H,2,13-14H2,1H3
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n/an/an/an/a 3.05E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48113
PNG
(2-[[2-[[1-(4-methylphenyl)-4-pyrazolo[3,4-d]pyrimi...)
Show SMILES CCOC(=O)CNC(=O)CSc1ncnc2n(ncc12)-c1ccc(C)cc1
Show InChI InChI=1S/C18H19N5O3S/c1-3-26-16(25)9-19-15(24)10-27-18-14-8-22-23(17(14)20-11-21-18)13-6-4-12(2)5-7-13/h4-8,11H,3,9-10H2,1-2H3,(H,19,24)
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n/an/an/an/a 2.80E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48114
PNG
(MLS000035120 | N-[6-(2-furoylamino)-3-pyridyl]pico...)
Show SMILES O=C(Nc1ccc(NC(=O)c2ccccn2)cn1)c1ccco1
Show InChI InChI=1S/C16H12N4O3/c21-15(12-4-1-2-8-17-12)19-11-6-7-14(18-10-11)20-16(22)13-5-3-9-23-13/h1-10H,(H,19,21)(H,18,20,22)
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n/an/an/an/a 9.01E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM40577
PNG
(4-(4-Pyrrolidin-1-yl-quinazolin-2-ylamino)-phenol ...)
Show SMILES Oc1ccc(Nc2nc(N3CCCC3)c3ccccc3n2)cc1
Show InChI InChI=1S/C18H18N4O/c23-14-9-7-13(8-10-14)19-18-20-16-6-2-1-5-15(16)17(21-18)22-11-3-4-12-22/h1-2,5-10,23H,3-4,11-12H2,(H,19,20,21)
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n/an/an/an/a 2.65E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM38869
PNG
(2-(4-Amino-phenyl)-7-chloro-3H-benzoimidazol-5-yla...)
Show SMILES Nc1ccc(cc1)-c1nc2c(Cl)cc(N)cc2[nH]1
Show InChI InChI=1S/C13H11ClN4/c14-10-5-9(16)6-11-12(10)18-13(17-11)7-1-3-8(15)4-2-7/h1-6H,15-16H2,(H,17,18)
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n/an/an/an/a 1.07E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48115
PNG
(3-(2-Chloro-benzyl)-7-hydroxy-3H-[1,2,3]triazolo[4...)
Show SMILES Clc1ccccc1Cn1nnc2c1nc([nH]c2=O)C(=O)NCc1cccs1
Show InChI InChI=1S/C17H13ClN6O2S/c18-12-6-2-1-4-10(12)9-24-15-13(22-23-24)16(25)21-14(20-15)17(26)19-8-11-5-3-7-27-11/h1-7H,8-9H2,(H,19,26)(H,20,21,25)
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n/an/an/an/a 5.00E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM50054601
PNG
(5-Methyl-N-(4-(trifluoromethyl)phenyl)-4-isoxazole...)
Show SMILES Cc1oncc1C(=O)Nc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C12H9F3N2O2/c1-7-10(6-16-19-7)11(18)17-9-4-2-8(3-5-9)12(13,14)15/h2-6H,1H3,(H,17,18)
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n/an/an/an/a 5.65E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48116
PNG
(1,1-bis(oxidanylidene)-2-phenacyl-1,2-benzothiazol...)
Show SMILES O=C(CN1C(=O)c2ccccc2S1(=O)=O)c1ccccc1
Show InChI InChI=1S/C15H11NO4S/c17-13(11-6-2-1-3-7-11)10-16-15(18)12-8-4-5-9-14(12)21(16,19)20/h1-9H,10H2
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n/an/an/an/a 5.00E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48117
PNG
(3-methyl-6-[(4-methylphenyl)sulfanylmethyl]imidazo...)
Show SMILES Cc1csc2nc(CSc3ccc(C)cc3)cn12
Show InChI InChI=1S/C14H14N2S2/c1-10-3-5-13(6-4-10)17-9-12-7-16-11(2)8-18-14(16)15-12/h3-8H,9H2,1-2H3
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n/an/an/an/a 5.82E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM36894
PNG
(5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide ...)
Show SMILES O=S1(=O)Nc2c(ccc3cccnc23)-c2ccccc12
Show InChI InChI=1S/C15H10N2O2S/c18-20(19)13-6-2-1-5-11(13)12-8-7-10-4-3-9-16-14(10)15(12)17-20/h1-9,17H
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n/an/an/an/a 2.46E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM34247
PNG
(3,6-bis(2-pyridinyl)pyridazine | 3,6-bis(2-pyridyl...)
Show SMILES c1ccc(nc1)-c1ccc(nn1)-c1ccccn1
Show InChI InChI=1S/C14H10N4/c1-3-9-15-11(5-1)13-7-8-14(18-17-13)12-6-2-4-10-16-12/h1-10H
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n/an/an/an/a 4.20E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48118
PNG
(3-(4-chlorophenyl)-6-(1-pyrrolidinyl)-1,2,4,5-tetr...)
Show SMILES Clc1ccc(cc1)-c1nnc(nn1)N1CCCC1
Show InChI InChI=1S/C12H12ClN5/c13-10-5-3-9(4-6-10)11-14-16-12(17-15-11)18-7-1-2-8-18/h3-6H,1-2,7-8H2
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n/an/an/an/a 6.38E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM37012
PNG
((2E)-1-(5-chloranyl-2-methylsulfonyl-pyrimidin-4-y...)
Show SMILES CN1\C(=C\C(=O)c2nc(ncc2Cl)S(C)(=O)=O)C(C)(C)c2ccccc12
Show InChI InChI=1S/C18H18ClN3O3S/c1-18(2)11-7-5-6-8-13(11)22(3)15(18)9-14(23)16-12(19)10-20-17(21-16)26(4,24)25/h5-10H,1-4H3/b15-9+
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n/an/an/an/a 1.61E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48132
PNG
(MLS000055504 | N-(3-imidazol-1-ylpropyl)-2-[(2,3,5...)
Show SMILES Cc1cc(C)c(C)c(c1C)S(=O)(=O)Nc1ccccc1C(=O)NCCCn1ccnc1
Show InChI InChI=1S/C23H28N4O3S/c1-16-14-17(2)19(4)22(18(16)3)31(29,30)26-21-9-6-5-8-20(21)23(28)25-10-7-12-27-13-11-24-15-27/h5-6,8-9,11,13-15,26H,7,10,12H2,1-4H3,(H,25,28)
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n/an/an/an/a 1.82E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48133
PNG
(2-methyl-6-phenyl-imidazo[2,1-b][1,3,4]thiadiazole...)
Show SMILES Cc1nn2cc(nc2s1)-c1ccccc1
Show InChI InChI=1S/C11H9N3S/c1-8-13-14-7-10(12-11(14)15-8)9-5-3-2-4-6-9/h2-7H,1H3
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n/an/an/an/a 1.23E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

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Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48134
PNG
(6-bromanyl-2-[(1-methylimidazol-2-yl)sulfanylmethy...)
Show SMILES Cn1ccnc1SCc1cn2cc(Br)ccc2n1
Show InChI InChI=1S/C12H11BrN4S/c1-16-5-4-14-12(16)18-8-10-7-17-6-9(13)2-3-11(17)15-10/h2-7H,8H2,1H3
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n/an/an/an/a 1.50E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48135
PNG
(5-[(4-ethoxyphenoxy)methyl]-2-furancarboxylic acid...)
Show SMILES CCOc1ccc(OCc2ccc(o2)C(O)=O)cc1
Show InChI InChI=1S/C14H14O5/c1-2-17-10-3-5-11(6-4-10)18-9-12-7-8-13(19-12)14(15)16/h3-8H,2,9H2,1H3,(H,15,16)
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n/an/an/an/a 5.80E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM38961
PNG
(2-(4-methyl-1-piperidinyl)-1,3-benzothiazole-6-car...)
Show SMILES CC1CCN(CC1)c1nc2ccc(cc2s1)C(O)=O
Show InChI InChI=1S/C14H16N2O2S/c1-9-4-6-16(7-5-9)14-15-11-3-2-10(13(17)18)8-12(11)19-14/h2-3,8-9H,4-7H2,1H3,(H,17,18)
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n/an/an/an/a 350n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM38963
PNG
(5-(benzoxymethyl)-7-(piperidinomethyl)quinolin-8-o...)
Show SMILES Oc1c(CN2CCCCC2)cc(COCc2ccccc2)c2cccnc12
Show InChI InChI=1S/C23H26N2O2/c26-23-19(15-25-12-5-2-6-13-25)14-20(21-10-7-11-24-22(21)23)17-27-16-18-8-3-1-4-9-18/h1,3-4,7-11,14,26H,2,5-6,12-13,15-17H2
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n/an/an/an/a 6.94E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48136
PNG
(1,7,7-trimethyl-9-oxidanylidene-N-(oxolan-2-ylmeth...)
Show SMILES Cc1c(oc2ccc3OC(C)(C)CC(=O)c3c12)C(=O)NCC1CCCO1
Show InChI InChI=1S/C20H23NO5/c1-11-16-14(6-7-15-17(16)13(22)9-20(2,3)26-15)25-18(11)19(23)21-10-12-5-4-8-24-12/h6-7,12H,4-5,8-10H2,1-3H3,(H,21,23)
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n/an/an/an/a 1.25E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM39104
PNG
(4-keto-N-(o-tolyl)pyrido[1,2-a]pyrimidine-3-carbox...)
Show SMILES Cc1ccccc1NC(=O)c1cnc2ccccn2c1=O
Show InChI InChI=1S/C16H13N3O2/c1-11-6-2-3-7-13(11)18-15(20)12-10-17-14-8-4-5-9-19(14)16(12)21/h2-10H,1H3,(H,18,20)
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n/an/an/an/a 2.13E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM38981
PNG
(4-[5-(4-ethoxyphenyl)-1,2-oxazol-3-yl]-N-(3-methox...)
Show SMILES CCOc1ccc(cc1)-c1cc(CCCC(=O)NCCCOC)no1
Show InChI InChI=1S/C19H26N2O4/c1-3-24-17-10-8-15(9-11-17)18-14-16(21-25-18)6-4-7-19(22)20-12-5-13-23-2/h8-11,14H,3-7,12-13H2,1-2H3,(H,20,22)
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n/an/an/an/a 8.32E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48120
PNG
(1-(4-methoxyphenyl)-N-prop-2-enyl-4-pyrazolo[3,4-d...)
Show SMILES COc1ccc(cc1)-n1ncc2c(NCC=C)ncnc12
Show InChI InChI=1S/C15H15N5O/c1-3-8-16-14-13-9-19-20(15(13)18-10-17-14)11-4-6-12(21-2)7-5-11/h3-7,9-10H,1,8H2,2H3,(H,16,17,18)
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n/an/an/an/a 8.50E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48121
PNG
(1-(4-methoxyphenyl)-N-(2-methylpropyl)-4-pyrazolo[...)
Show SMILES COc1ccc(cc1)-n1ncc2c(NCC(C)C)ncnc12
Show InChI InChI=1S/C16H19N5O/c1-11(2)8-17-15-14-9-20-21(16(14)19-10-18-15)12-4-6-13(22-3)7-5-12/h4-7,9-11H,8H2,1-3H3,(H,17,18,19)
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n/an/an/an/a 6.31E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48122
PNG
(5-bromanyl-N-(1,5-dimethyl-3-oxidanylidene-2-pheny...)
Show SMILES Cc1c(NC(=O)c2coc(=O)c(Br)c2)c(=O)n(-c2ccccc2)n1C
Show InChI InChI=1S/C17H14BrN3O4/c1-10-14(19-15(22)11-8-13(18)17(24)25-9-11)16(23)21(20(10)2)12-6-4-3-5-7-12/h3-9H,1-2H3,(H,19,22)
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n/an/an/an/a 1.31E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48123
PNG
(2-(2,4-dimethylphenyl)-1,3-benzoxazol-5-amine | ML...)
Show SMILES Cc1ccc(-c2nc3cc(N)ccc3o2)c(C)c1
Show InChI InChI=1S/C15H14N2O/c1-9-3-5-12(10(2)7-9)15-17-13-8-11(16)4-6-14(13)18-15/h3-8H,16H2,1-2H3
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n/an/an/an/a 2.68E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48124
PNG
((4,8-dimethylquinazolin-2-yl)-[3-(3-morpholinoprop...)
Show SMILES Cc1cccc2c(C)nc(NC3=NCN(CCCN4CCOCC4)CN3)nc12
Show InChI InChI=1S/C20H29N7O/c1-15-5-3-6-17-16(2)23-20(24-18(15)17)25-19-21-13-27(14-22-19)8-4-7-26-9-11-28-12-10-26/h3,5-6H,4,7-14H2,1-2H3,(H2,21,22,23,24,25)
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n/an/an/an/a 3.43E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM38917
PNG
(3-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]pro...)
Show SMILES CC(C)(C)c1ccc(cc1)-c1noc(CCC(N)=O)n1
Show InChI InChI=1S/C15H19N3O2/c1-15(2,3)11-6-4-10(5-7-11)14-17-13(20-18-14)9-8-12(16)19/h4-7H,8-9H2,1-3H3,(H2,16,19)
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n/an/an/an/a 130n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM39080
PNG
(4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butano...)
Show SMILES COc1ccc(cc1)-c1noc(CCCC(O)=O)n1
Show InChI InChI=1S/C13H14N2O4/c1-18-10-7-5-9(6-8-10)13-14-11(19-15-13)3-2-4-12(16)17/h5-8H,2-4H2,1H3,(H,16,17)
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n/an/an/an/a 770n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48125
PNG
(2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-6...)
Show SMILES CCc1cc2c(nc(SCc3c(C)noc3C)n(Cc3ccco3)c2=O)s1
Show InChI InChI=1S/C19H19N3O3S2/c1-4-14-8-15-17(27-14)20-19(26-10-16-11(2)21-25-12(16)3)22(18(15)23)9-13-6-5-7-24-13/h5-8H,4,9-10H2,1-3H3
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n/an/an/an/a 5.00E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48126
PNG
((6-chloranylimidazo[2,1-b][1,3]thiazol-5-yl)-[4-(3...)
Show SMILES Clc1nc2sccn2c1C(=O)N1CCN(CC1)c1cccc(Cl)c1
Show InChI InChI=1S/C16H14Cl2N4OS/c17-11-2-1-3-12(10-11)20-4-6-21(7-5-20)15(23)13-14(18)19-16-22(13)8-9-24-16/h1-3,8-10H,4-7H2
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n/an/an/an/a 4.86E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM38928
PNG
(3-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]...)
Show SMILES Clc1ccc(cc1)C(=O)N1CCCCC(Sc2nnc(o2)-c2ccc3OCOc3c2)C1=O
Show InChI InChI=1S/C22H18ClN3O5S/c23-15-7-4-13(5-8-15)20(27)26-10-2-1-3-18(21(26)28)32-22-25-24-19(31-22)14-6-9-16-17(11-14)30-12-29-16/h4-9,11,18H,1-3,10,12H2
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n/an/an/an/a 140n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM36973
PNG
(1-[[5-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-...)
Show SMILES Cc1ccc(cc1)-c1csc2ncnc(Sc3nnc(CN4CCCCCC4=O)o3)c12
Show InChI InChI=1S/C22H21N5O2S2/c1-14-6-8-15(9-7-14)16-12-30-20-19(16)21(24-13-23-20)31-22-26-25-17(29-22)11-27-10-4-2-3-5-18(27)28/h6-9,12-13H,2-5,10-11H2,1H3
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n/an/an/an/a 1.50E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM36986
PNG
(1-(2,5-dimethyl-1-phenyl-3-pyrrolyl)-2-[(5-thiophe...)
Show SMILES Cc1cc(C(=O)CSc2nnc(o2)-c2cccs2)c(C)n1-c1ccccc1
Show InChI InChI=1S/C20H17N3O2S2/c1-13-11-16(14(2)23(13)15-7-4-3-5-8-15)17(24)12-27-20-22-21-19(25-20)18-9-6-10-26-18/h3-11H,12H2,1-2H3
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n/an/an/an/a 7.72E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48127
PNG
(3-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsul...)
Show SMILES O=c1n(CSc2nnc3sc4ccccc4n23)nnc2ccccc12
Show InChI InChI=1S/C16H10N6OS2/c23-14-10-5-1-2-6-11(10)17-20-21(14)9-24-15-18-19-16-22(15)12-7-3-4-8-13(12)25-16/h1-8H,9H2
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n/an/an/an/a 8.02E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM38934
PNG
(MLS000058142 | N-[4-[2-[2,5-dimethyl-1-(thiophen-2...)
Show SMILES CC(=O)Nc1ccc(SCC(=O)c2cc(C)n(Cc3cccs3)c2C)cc1
Show InChI InChI=1S/C21H22N2O2S2/c1-14-11-20(15(2)23(14)12-19-5-4-10-26-19)21(25)13-27-18-8-6-17(7-9-18)22-16(3)24/h4-11H,12-13H2,1-3H3,(H,22,24)
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n/an/an/an/a 1.22E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM39096
PNG
(2-[2-[2,5-dimethyl-1-(2-oxolanylmethyl)-3-pyrrolyl...)
Show SMILES Cc1cc(C(=O)CN2C(=O)c3ccccc3S2(=O)=O)c(C)n1CC1CCCO1
Show InChI InChI=1S/C20H22N2O5S/c1-13-10-17(14(2)21(13)11-15-6-5-9-27-15)18(23)12-22-20(24)16-7-3-4-8-19(16)28(22,25)26/h3-4,7-8,10,15H,5-6,9,11-12H2,1-2H3
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n/an/an/an/a 110n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48128
PNG
(MLS000057148 | N-[4-[2-[1-(2-methoxyethyl)-2,5-dim...)
Show SMILES COCCn1c(C)cc(C(=O)CSc2ccc(NC(C)=O)cc2)c1C
Show InChI InChI=1S/C19H24N2O3S/c1-13-11-18(14(2)21(13)9-10-24-4)19(23)12-25-17-7-5-16(6-8-17)20-15(3)22/h5-8,11H,9-10,12H2,1-4H3,(H,20,22)
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n/an/an/an/a 8.54E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48129
PNG
(4-[2,5-dimethyl-1-(2-phenylethyl)-3-pyrrolyl]-2-th...)
Show SMILES Cc1cc(-c2csc(N)n2)c(C)n1CCc1ccccc1
Show InChI InChI=1S/C17H19N3S/c1-12-10-15(16-11-21-17(18)19-16)13(2)20(12)9-8-14-6-4-3-5-7-14/h3-7,10-11H,8-9H2,1-2H3,(H2,18,19)
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n/an/an/an/a 1.32E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM48130
PNG
(2-[(3-chloranylimidazo[1,2-a]pyridin-2-yl)methylsu...)
Show SMILES Clc1c(CSc2nc3ccccc3o2)nc2ccccn12
Show InChI InChI=1S/C15H10ClN3OS/c16-14-11(17-13-7-3-4-8-19(13)14)9-21-15-18-10-5-1-2-6-12(10)20-15/h1-8H,9H2
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n/an/an/an/a 1.21E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM39980
PNG
(MLS000099000 | N-(3-aminocarbonyl-5,6-dihydro-4H-c...)
Show SMILES NC(=O)c1c(NC(=O)c2cc3ccccc3o2)sc2CCCc12
Show InChI InChI=1S/C17H14N2O3S/c18-15(20)14-10-5-3-7-13(10)23-17(14)19-16(21)12-8-9-4-1-2-6-11(9)22-12/h1-2,4,6,8H,3,5,7H2,(H2,18,20)(H,19,21)
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n/an/an/an/a 6.54E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
matrix metalloproteinase 1


(Homo sapiens)
BDBM38941
PNG
(1-(2-phenoxyethylsulfanyl)-[1,2,4]triazolo[3,4-b][...)
Show SMILES C(CSc1nnc2sc3ccccc3n12)Oc1ccccc1
Show InChI InChI=1S/C16H13N3OS2/c1-2-6-12(7-3-1)20-10-11-21-15-17-18-16-19(15)13-8-4-5-9-14(13)22-16/h1-9H,10-11H2
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n/an/an/an/a 1.43E+3n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)

More data for this
Ligand-Target Pair
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