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21 similar compounds to monomer 50100940

Compile data set for download or QSAR
Wt: 866.7
BDBM50240460
Purchase
Wt: 592.5
BDBM50260060
Purchase
Wt: 562.5
BDBM50269604
Wt: 1443.2
BDBM50310256
Wt: 866.7
BDBM50310254
Wt: 866.7
BDBM50310255
Wt: 461.5
BDBM50227135
Wt: 435.4
BDBM50227136
Wt: 415.4
BDBM50227134
Wt: 431.4
BDBM50227137
Wt: 419.6
BDBM50223786
Wt: 407.4
BDBM50227138
Wt: 465.5
BDBM50227139
Wt: 419.6
BDBM50223785

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 19 hits for monomerid = 50240460,50260060,50269604,50310256,50310254,50310255,50227135,50227136,50227134,50227137,50223786,50227138,50227139,50223785   
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
Collagenase


(Homo sapiens (Human))
BDBM50240460
PNG
((2R,3R,4R,2'R,3'R,4'S,2''R,3''R)-2,2',2''-Tris-(3,...)
Show SMILES O[C@@H]1Cc2c(O)cc(O)c([C@@H]3[C@@H](O)[C@H](Oc4c([C@@H]5[C@@H](O)[C@H](Oc6cc(O)cc(O)c56)c5ccc(O)c(O)c5)c(O)cc(O)c34)c3ccc(O)c(O)c3)c2O[C@@H]1c1ccc(O)c(O)c1
Show InChI InChI=1S/C45H38O18/c46-18-10-27(54)33-32(11-18)61-42(16-2-5-21(48)25(52)8-16)39(59)37(33)35-29(56)14-30(57)36-38(40(60)43(63-45(35)36)17-3-6-22(49)26(53)9-17)34-28(55)13-23(50)19-12-31(58)41(62-44(19)34)15-1-4-20(47)24(51)7-15/h1-11,13-14,31,37-43,46-60H,12H2/t31-,37-,38+,39-,40-,41-,42-,43-/m1/s1
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n/an/a 5.32E+4n/an/an/an/an/an/a



Wonkwang University Sanbon Medical Center

Curated by ChEMBL


Assay Description
Inhibition of human neutrophils gelatinase B after 30 mins by fluorescence plate reader


Bioorg Med Chem Lett 20: 991-3 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.059
BindingDB Entry DOI: 10.7270/Q2NP24J0
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor


(Homo sapiens (Human))
BDBM50227139
PNG
(CHEMBL81585)
Show SMILES CCCCCCCCCOc1ccc(cc1)C(=O)Nc1cccc2OCC(Oc12)c1nnn[nH]1
Show InChI InChI=1S/C25H31N5O4/c1-2-3-4-5-6-7-8-16-32-19-14-12-18(13-15-19)25(31)26-20-10-9-11-21-23(20)34-22(17-33-21)24-27-29-30-28-24/h9-15,22H,2-8,16-17H2,1H3,(H,26,31)(H,27,28,29,30)
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n/an/a 20n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of LTC4 induced smooth muscle contraction of guinea pig ileum


J Med Chem 31: 84-91 (1988)


Article DOI: 10.1021/jm00396a013
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50310255
PNG
(CHEMBL592228 | epicatechin-(4beta-6)-epicatechin-(...)
Show SMILES O[C@@H]1Cc2c(O)cc(O)c(C3[C@@H](O)[C@H](Oc4cc(O)c([C@@H]5[C@@H](O)[C@H](Oc6cc(O)cc(O)c56)c5ccc(O)c(O)c5)c(O)c34)c3ccc(O)c(O)c3)c2O[C@@H]1c1ccc(O)c(O)c1
Show InChI InChI=1S/C45H38O18/c46-18-10-27(54)33-31(11-18)61-43(16-2-5-21(48)25(52)8-16)40(59)37(33)34-29(56)14-32-36(39(34)58)38(41(60)44(62-32)17-3-6-22(49)26(53)9-17)35-28(55)13-23(50)19-12-30(57)42(63-45(19)35)15-1-4-20(47)24(51)7-15/h1-11,13-14,30,37-38,40-44,46-60H,12H2/t30-,37-,38?,40-,41-,42-,43-,44-/m1/s1
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n/an/a 2.30E+3n/an/an/an/an/an/a



Wonkwang University Sanbon Medical Center

Curated by ChEMBL


Assay Description
Inhibition of human neutrophils gelatinase B after 30 mins by fluorescence plate reader


Bioorg Med Chem Lett 20: 991-3 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.059
BindingDB Entry DOI: 10.7270/Q2NP24J0
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50310256
PNG
(CHEMBL592373 | epicatechin-(4beta-8)-epicatechin-(...)
Show SMILES O[C@@H]1Cc2c(O)cc(O)c([C@@H]3[C@@H](O)[C@H](Oc4c3c(O)cc(O)c4[C@@H]3[C@@H](O)[C@H](Oc4c([C@@H]5[C@@H](O)[C@H](Oc6c([C@@H]7[C@@H](O)[C@H](Oc8cc(O)cc(O)c78)c7ccc(O)c(O)c7)c(O)cc(O)c56)c5ccc(O)c(O)c5)c(O)cc(O)c34)c3ccc(O)c(O)c3)c3ccc(O)c(O)c3)c2O[C@@H]1c1ccc(O)c(O)c1
Show InChI InChI=1S/C75H62O30/c76-28-16-41(88)51-50(17-28)101-68(24-2-7-31(78)37(84)12-24)63(97)59(51)53-43(90)20-45(92)55-61(65(99)70(103-73(53)55)26-4-9-33(80)39(86)14-26)57-47(94)22-48(95)58-62(66(100)71(105-75(57)58)27-5-10-34(81)40(87)15-27)56-46(93)21-44(91)54-60(64(98)69(104-74(54)56)25-3-8-32(79)38(85)13-25)52-42(89)19-35(82)29-18-49(96)67(102-72(29)52)23-1-6-30(77)36(83)11-23/h1-17,19-22,49,59-71,76-100H,18H2/t49-,59-,60+,61-,62+,63-,64-,65-,66-,67-,68-,69-,70-,71-/m1/s1
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n/an/a 3.92E+4n/an/an/an/an/an/a



Wonkwang University Sanbon Medical Center

Curated by ChEMBL


Assay Description
Inhibition of human neutrophils gelatinase B after 30 mins by fluorescence plate reader


Bioorg Med Chem Lett 20: 991-3 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.059
BindingDB Entry DOI: 10.7270/Q2NP24J0
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50240460
PNG
((2R,3R,4R,2'R,3'R,4'S,2''R,3''R)-2,2',2''-Tris-(3,...)
Show SMILES O[C@@H]1Cc2c(O)cc(O)c([C@@H]3[C@@H](O)[C@H](Oc4c([C@@H]5[C@@H](O)[C@H](Oc6cc(O)cc(O)c56)c5ccc(O)c(O)c5)c(O)cc(O)c34)c3ccc(O)c(O)c3)c2O[C@@H]1c1ccc(O)c(O)c1
Show InChI InChI=1S/C45H38O18/c46-18-10-27(54)33-32(11-18)61-42(16-2-5-21(48)25(52)8-16)39(59)37(33)35-29(56)14-30(57)36-38(40(60)43(63-45(35)36)17-3-6-22(49)26(53)9-17)34-28(55)13-23(50)19-12-31(58)41(62-44(19)34)15-1-4-20(47)24(51)7-15/h1-11,13-14,31,37-43,46-60H,12H2/t31-,37-,38+,39-,40-,41-,42-,43-/m1/s1
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n/an/a 3.14E+4n/an/an/an/an/an/a



Wonkwang University Sanbon Medical Center

Curated by ChEMBL


Assay Description
Inhibition of human rheumatoid synovial fibroblasts gelatinase A after 30 mins by fluorescence plate reader


Bioorg Med Chem Lett 20: 991-3 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.059
BindingDB Entry DOI: 10.7270/Q2NP24J0
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50310254
PNG
(CHEMBL592329 | epicatechin-(4beta-8)-epicatechin-(...)
Show SMILES O[C@@H]1Cc2c(O)c([C@@H]3[C@@H](O)[C@H](Oc4c3c(O)cc(O)c4[C@@H]3[C@@H](O)[C@H](Oc4cc(O)cc(O)c34)c3ccc(O)c(O)c3)c3ccc(O)c(O)c3)c(O)cc2O[C@@H]1c1ccc(O)c(O)c1
Show InChI InChI=1S/C45H38O18/c46-18-10-26(53)33-32(11-18)62-43(16-2-5-21(48)24(51)8-16)40(59)37(33)35-27(54)13-28(55)36-38(41(60)44(63-45(35)36)17-3-6-22(49)25(52)9-17)34-29(56)14-31-19(39(34)58)12-30(57)42(61-31)15-1-4-20(47)23(50)7-15/h1-11,13-14,30,37-38,40-44,46-60H,12H2/t30-,37-,38+,40-,41-,42-,43-,44-/m1/s1
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n/an/a 1.24E+4n/an/an/an/an/an/a



Wonkwang University Sanbon Medical Center

Curated by ChEMBL


Assay Description
Inhibition of human rheumatoid synovial fibroblasts gelatinase A after 30 mins by fluorescence plate reader


Bioorg Med Chem Lett 20: 991-3 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.059
BindingDB Entry DOI: 10.7270/Q2NP24J0
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50310255
PNG
(CHEMBL592228 | epicatechin-(4beta-6)-epicatechin-(...)
Show SMILES O[C@@H]1Cc2c(O)cc(O)c(C3[C@@H](O)[C@H](Oc4cc(O)c([C@@H]5[C@@H](O)[C@H](Oc6cc(O)cc(O)c56)c5ccc(O)c(O)c5)c(O)c34)c3ccc(O)c(O)c3)c2O[C@@H]1c1ccc(O)c(O)c1
Show InChI InChI=1S/C45H38O18/c46-18-10-27(54)33-31(11-18)61-43(16-2-5-21(48)25(52)8-16)40(59)37(33)34-29(56)14-32-36(39(34)58)38(41(60)44(62-32)17-3-6-22(49)26(53)9-17)35-28(55)13-23(50)19-12-30(57)42(63-45(19)35)15-1-4-20(47)24(51)7-15/h1-11,13-14,30,37-38,40-44,46-60H,12H2/t30-,37-,38?,40-,41-,42-,43-,44-/m1/s1
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n/an/a 400n/an/an/an/an/an/a



Wonkwang University Sanbon Medical Center

Curated by ChEMBL


Assay Description
Inhibition of human rheumatoid synovial fibroblasts gelatinase A after 30 mins by fluorescence plate reader


Bioorg Med Chem Lett 20: 991-3 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.059
BindingDB Entry DOI: 10.7270/Q2NP24J0
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50310256
PNG
(CHEMBL592373 | epicatechin-(4beta-8)-epicatechin-(...)
Show SMILES O[C@@H]1Cc2c(O)cc(O)c([C@@H]3[C@@H](O)[C@H](Oc4c3c(O)cc(O)c4[C@@H]3[C@@H](O)[C@H](Oc4c([C@@H]5[C@@H](O)[C@H](Oc6c([C@@H]7[C@@H](O)[C@H](Oc8cc(O)cc(O)c78)c7ccc(O)c(O)c7)c(O)cc(O)c56)c5ccc(O)c(O)c5)c(O)cc(O)c34)c3ccc(O)c(O)c3)c3ccc(O)c(O)c3)c2O[C@@H]1c1ccc(O)c(O)c1
Show InChI InChI=1S/C75H62O30/c76-28-16-41(88)51-50(17-28)101-68(24-2-7-31(78)37(84)12-24)63(97)59(51)53-43(90)20-45(92)55-61(65(99)70(103-73(53)55)26-4-9-33(80)39(86)14-26)57-47(94)22-48(95)58-62(66(100)71(105-75(57)58)27-5-10-34(81)40(87)15-27)56-46(93)21-44(91)54-60(64(98)69(104-74(54)56)25-3-8-32(79)38(85)13-25)52-42(89)19-35(82)29-18-49(96)67(102-72(29)52)23-1-6-30(77)36(83)11-23/h1-17,19-22,49,59-71,76-100H,18H2/t49-,59-,60+,61-,62+,63-,64-,65-,66-,67-,68-,69-,70-,71-/m1/s1
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n/an/a 4.32E+4n/an/an/an/an/an/a



Wonkwang University Sanbon Medical Center

Curated by ChEMBL


Assay Description
Inhibition of human rheumatoid synovial fibroblasts gelatinase A after 30 mins by fluorescence plate reader


Bioorg Med Chem Lett 20: 991-3 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.059
BindingDB Entry DOI: 10.7270/Q2NP24J0
More data for this
Ligand-Target Pair
Cyclooxygenase-1 (COX-1)


(Homo sapiens (Human))
BDBM50260060
PNG
(CHEMBL503797 | ouratea-proanthocyanidin A | ourate...)
Show SMILES COc1c(O)cc(cc1O)[C@H]1Oc2c(C[C@H]1O)c(O)cc(O)c2[C@@H]1[C@@H](O)[C@H](Oc2cc(O)cc(O)c12)c1ccc(O)cc1
Show InChI InChI=1S/C31H28O12/c1-41-31-20(37)6-13(7-21(31)38)28-22(39)10-16-17(34)11-19(36)25(30(16)43-28)26-24-18(35)8-15(33)9-23(24)42-29(27(26)40)12-2-4-14(32)5-3-12/h2-9,11,22,26-29,32-40H,10H2,1H3/t22-,26-,27-,28-,29-/m1/s1
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n/an/a 1.38E+5n/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
Inhibition of COX1


J Nat Prod 68: 985-91 (2005)


Article DOI: 10.1021/np049655u
BindingDB Entry DOI: 10.7270/Q27S7PN5
More data for this
Ligand-Target Pair
Cyclooxygenase-1 (COX-1)


(Homo sapiens (Human))
BDBM50269604
PNG
(CHEMBL447023 | epiafzelechin-(4beta->8)-epicatechi...)
Show SMILES O[C@@H]1Cc2c(O)cc(O)c([C@@H]3[C@@H](O)[C@H](Oc4cc(O)cc(O)c34)c3ccc(O)c(O)c3)c2O[C@@H]1c1ccc(O)cc1
Show InChI InChI=1S/C30H26O11/c31-14-4-1-12(2-5-14)28-22(38)10-16-18(34)11-21(37)25(30(16)41-28)26-24-20(36)8-15(32)9-23(24)40-29(27(26)39)13-3-6-17(33)19(35)7-13/h1-9,11,22,26-29,31-39H,10H2/t22-,26-,27-,28-,29-/m1/s1
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n/an/a 7.80E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of COX1


J Nat Prod 65: 163-9 (2002)


Article DOI: 10.1021/np010451c
BindingDB Entry DOI: 10.7270/Q2J38TGV
More data for this
Ligand-Target Pair
Cyclooxygenase


(Homo sapiens (Human))
BDBM50269604
PNG
(CHEMBL447023 | epiafzelechin-(4beta->8)-epicatechi...)
Show SMILES O[C@@H]1Cc2c(O)cc(O)c([C@@H]3[C@@H](O)[C@H](Oc4cc(O)cc(O)c34)c3ccc(O)c(O)c3)c2O[C@@H]1c1ccc(O)cc1
Show InChI InChI=1S/C30H26O11/c31-14-4-1-12(2-5-14)28-22(38)10-16-18(34)11-21(37)25(30(16)41-28)26-24-20(36)8-15(32)9-23(24)40-29(27(26)39)13-3-6-17(33)19(35)7-13/h1-9,11,22,26-29,31-39H,10H2/t22-,26-,27-,28-,29-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of COX2


J Nat Prod 65: 163-9 (2002)


Article DOI: 10.1021/np010451c
BindingDB Entry DOI: 10.7270/Q2J38TGV
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50223785
PNG
(CHEMBL163834)
Show SMILES CN(c1ccc(C\N=C(/S)NCc2ccc(cc2)C(C)(C)C)cc1)S(C)(=O)=O
Show InChI InChI=1S/C21H29N3O2S2/c1-21(2,3)18-10-6-16(7-11-18)14-22-20(27)23-15-17-8-12-19(13-9-17)24(4)28(5,25)26/h6-13H,14-15H2,1-5H3,(H2,22,23,27)
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n/an/a 2.50E+3n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro antagonist activity at the vanilloid receptor in rat DRG neurons.


Bioorg Med Chem Lett 14: 787-91 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.019
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50223786
PNG
(CHEMBL165036)
Show SMILES CCS(=O)(=O)Nc1ccc(C\N=C(/S)NCc2ccc(cc2)C(C)(C)C)cc1
Show InChI InChI=1S/C21H29N3O2S2/c1-5-28(25,26)24-19-12-8-17(9-13-19)15-23-20(27)22-14-16-6-10-18(11-7-16)21(2,3)4/h6-13,24H,5,14-15H2,1-4H3,(H2,22,23,27)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro antagonist activity at the vanilloid receptor in rat DRG neurons.


Bioorg Med Chem Lett 14: 787-91 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.019
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor


(Homo sapiens (Human))
BDBM50227134
PNG
(CHEMBL173692)
Show SMILES CCCCc1ccc(\C=C\C(=O)Nc2cccc3c2oc(cc3=O)-c2nn[nH]n2)cc1
Show InChI InChI=1S/C23H21N5O3/c1-2-3-5-15-8-10-16(11-9-15)12-13-21(30)24-18-7-4-6-17-19(29)14-20(31-22(17)18)23-25-27-28-26-23/h4,6-14H,2-3,5H2,1H3,(H,24,30)(H,25,26,27,28)/b13-12+
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n/an/a 34n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of LTC4 induced smooth muscle contraction of guinea pig ileum


J Med Chem 31: 84-91 (1988)


Article DOI: 10.1021/jm00396a013
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor


(Homo sapiens (Human))
BDBM50227135
PNG
(CHEMBL170678)
Show SMILES CCCCCCCCc1ccc(\C=C\C(=O)Nc2cccc3OCC(Oc23)c2nnn[nH]2)cc1
Show InChI InChI=1S/C26H31N5O3/c1-2-3-4-5-6-7-9-19-12-14-20(15-13-19)16-17-24(32)27-21-10-8-11-22-25(21)34-23(18-33-22)26-28-30-31-29-26/h8,10-17,23H,2-7,9,18H2,1H3,(H,27,32)(H,28,29,30,31)/b17-16+
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n/an/a 580n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of LTC4 induced smooth muscle contraction of guinea pig ileum


J Med Chem 31: 84-91 (1988)


Article DOI: 10.1021/jm00396a013
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor


(Homo sapiens (Human))
BDBM50227136
PNG
(CHEMBL170100)
Show SMILES CCCC\C=C\COc1ccc(cc1)C(=O)Nc1cccc2OCC(Oc12)c1nnn[nH]1
Show InChI InChI=1S/C23H25N5O4/c1-2-3-4-5-6-14-30-17-12-10-16(11-13-17)23(29)24-18-8-7-9-19-21(18)32-20(15-31-19)22-25-27-28-26-22/h5-13,20H,2-4,14-15H2,1H3,(H,24,29)(H,25,26,27,28)/b6-5+
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n/an/a 0.470n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of LTC4 induced smooth muscle contraction of guinea pig ileum


J Med Chem 31: 84-91 (1988)


Article DOI: 10.1021/jm00396a013
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor


(Homo sapiens (Human))
BDBM50227137
PNG
(CHEMBL422917)
Show SMILES CCC\C=C\COc1ccc(cc1)C(=O)Nc1cccc2c1oc(cc2=O)-c1nn[nH]n1
Show InChI InChI=1S/C23H21N5O4/c1-2-3-4-5-13-31-16-11-9-15(10-12-16)23(30)24-18-8-6-7-17-19(29)14-20(32-21(17)18)22-25-27-28-26-22/h4-12,14H,2-3,13H2,1H3,(H,24,30)(H,25,26,27,28)/b5-4+
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n/an/a 1.5n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of LTC4 induced smooth muscle contraction of guinea pig ileum


J Med Chem 31: 84-91 (1988)


Article DOI: 10.1021/jm00396a013
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor


(Homo sapiens (Human))
BDBM50227138
PNG
(CHEMBL171074)
Show SMILES CCCOc1ccc(\C=C\C(=O)Nc2cccc3OCC(Oc23)c2nnn[nH]2)cc1
Show InChI InChI=1S/C21H21N5O4/c1-2-12-28-15-9-6-14(7-10-15)8-11-19(27)22-16-4-3-5-17-20(16)30-18(13-29-17)21-23-25-26-24-21/h3-11,18H,2,12-13H2,1H3,(H,22,27)(H,23,24,25,26)/b11-8+
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n/an/a 660n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of LTC4 induced smooth muscle contraction of guinea pig ileum


J Med Chem 31: 84-91 (1988)


Article DOI: 10.1021/jm00396a013
More data for this
Ligand-Target Pair
Collagenase


(Homo sapiens (Human))
BDBM50310254
PNG
(CHEMBL592329 | epicatechin-(4beta-8)-epicatechin-(...)
Show SMILES O[C@@H]1Cc2c(O)c([C@@H]3[C@@H](O)[C@H](Oc4c3c(O)cc(O)c4[C@@H]3[C@@H](O)[C@H](Oc4cc(O)cc(O)c34)c3ccc(O)c(O)c3)c3ccc(O)c(O)c3)c(O)cc2O[C@@H]1c1ccc(O)c(O)c1
Show InChI InChI=1S/C45H38O18/c46-18-10-26(53)33-32(11-18)62-43(16-2-5-21(48)24(51)8-16)40(59)37(33)35-27(54)13-28(55)36-38(41(60)44(63-45(35)36)17-3-6-22(49)25(52)9-17)34-29(56)14-31-19(39(34)58)12-30(57)42(61-31)15-1-4-20(47)23(50)7-15/h1-11,13-14,30,37-38,40-44,46-60H,12H2/t30-,37-,38+,40-,41-,42-,43-,44-/m1/s1
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n/an/a 2.73E+4n/an/an/an/an/an/a



Wonkwang University Sanbon Medical Center

Curated by ChEMBL


Assay Description
Inhibition of human neutrophils gelatinase B after 30 mins by fluorescence plate reader


Bioorg Med Chem Lett 20: 991-3 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.059
BindingDB Entry DOI: 10.7270/Q2NP24J0
More data for this
Ligand-Target Pair