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5 similar compounds to monomer 50064182

Compile data set for download or QSAR
Wt: 434.3
BDBM50064184
Wt: 424.3
BDBM50064185
Wt: 464.4
BDBM50073331
Wt: 464.4
BDBM50073332
Wt: 464.4
BDBM50073333

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 9 hits for monomerid = 50064184,50064185,50073331,50073332,50073333   
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
Vacuolar H(+)-transporting ATPase 116 kDa subunit, a1 isoform


(Gallus gallus)
BDBM50064185
PNG
((2Z,4E)-5-(5,6-Dichloro-1H-indol-2-yl)-2-methoxy-p...)
Show SMILES CCN(CC)CCCNC(=O)C(\OC)=C\C=C\c1cc2cc(Cl)c(Cl)cc2[nH]1
Show InChI InChI=1S/C21H27Cl2N3O2/c1-4-26(5-2)11-7-10-24-21(27)20(28-3)9-6-8-16-12-15-13-17(22)18(23)14-19(15)25-16/h6,8-9,12-14,25H,4-5,7,10-11H2,1-3H3,(H,24,27)/b8-6+,20-9-
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n/an/a 2.80E+3n/an/an/an/an/an/a



SmithKline Beecham S.p.A.

Curated by ChEMBL


Assay Description
Compound was tested for inhibititon of V-ATPase from Chicken adrenal glands(cAG)


J Med Chem 41: 1568-73 (1998)


Article DOI: 10.1021/jm9800144
BindingDB Entry DOI: 10.7270/Q2CJ8CM6
More data for this
Ligand-Target Pair
Vacuolar H(+)-transporting ATPase 116 kDa subunit, a1 isoform


(Gallus gallus)
BDBM50064184
PNG
((2Z,4E)-5-(5,6-Dichloro-1H-indol-2-yl)-2-methoxy-p...)
Show SMILES CO\C(=C/C=C/c1cc2cc(Cl)c(Cl)cc2[nH]1)C(=O)NC1C[C@@H]2CC[C@H](C1)N2C
Show InChI InChI=1S/C22H25Cl2N3O2/c1-27-16-6-7-17(27)11-15(10-16)26-22(28)21(29-2)5-3-4-14-8-13-9-18(23)19(24)12-20(13)25-14/h3-5,8-9,12,15-17,25H,6-7,10-11H2,1-2H3,(H,26,28)/b4-3+,21-5-/t15?,16-,17+
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n/an/a 100n/an/an/an/an/an/a



SmithKline Beecham S.p.A.

Curated by ChEMBL


Assay Description
Compound was tested for inhibititon of V-ATPase from Chicken osteoclasts(cOc)


J Med Chem 41: 1568-73 (1998)


Article DOI: 10.1021/jm9800144
BindingDB Entry DOI: 10.7270/Q2CJ8CM6
More data for this
Ligand-Target Pair
Vacuolar H(+)-transporting ATPase 116 kDa subunit, a1 isoform


(Gallus gallus)
BDBM50064184
PNG
((2Z,4E)-5-(5,6-Dichloro-1H-indol-2-yl)-2-methoxy-p...)
Show SMILES CO\C(=C/C=C/c1cc2cc(Cl)c(Cl)cc2[nH]1)C(=O)NC1C[C@@H]2CC[C@H](C1)N2C
Show InChI InChI=1S/C22H25Cl2N3O2/c1-27-16-6-7-17(27)11-15(10-16)26-22(28)21(29-2)5-3-4-14-8-13-9-18(23)19(24)12-20(13)25-14/h3-5,8-9,12,15-17,25H,6-7,10-11H2,1-2H3,(H,26,28)/b4-3+,21-5-/t15?,16-,17+
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n/an/a 2.50E+3n/an/an/an/an/an/a



SmithKline Beecham S.p.A.

Curated by ChEMBL


Assay Description
Compound was tested for inhibititon of V-ATPase from Chicken adrenal glands(cAG)


J Med Chem 41: 1568-73 (1998)


Article DOI: 10.1021/jm9800144
BindingDB Entry DOI: 10.7270/Q2CJ8CM6
More data for this
Ligand-Target Pair
Vacuolar H(+)-transporting ATPase 116 kDa subunit, a1 isoform


(Gallus gallus)
BDBM50064185
PNG
((2Z,4E)-5-(5,6-Dichloro-1H-indol-2-yl)-2-methoxy-p...)
Show SMILES CCN(CC)CCCNC(=O)C(\OC)=C\C=C\c1cc2cc(Cl)c(Cl)cc2[nH]1
Show InChI InChI=1S/C21H27Cl2N3O2/c1-4-26(5-2)11-7-10-24-21(27)20(28-3)9-6-8-16-12-15-13-17(22)18(23)14-19(15)25-16/h6,8-9,12-14,25H,4-5,7,10-11H2,1-3H3,(H,24,27)/b8-6+,20-9-
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n/an/a 2.80E+3n/an/an/an/an/an/a



SmithKline Beecham S.p.A.

Curated by ChEMBL


Assay Description
Compound was tested for inhibititon of V-ATPase from Chicken adrenal glands(cAG)


J Med Chem 41: 1568-73 (1998)


Article DOI: 10.1021/jm9800144
BindingDB Entry DOI: 10.7270/Q2CJ8CM6
More data for this
Ligand-Target Pair
Potassium-transporting ATPase


(Sus scrofa (Pig))
BDBM50073333
PNG
((2E,4E)-5-(5,6-Dichloro-1H-indol-2-yl)-2-methoxy-p...)
Show SMILES CO\C(=C\C=C\c1cc2cc(Cl)c(Cl)cc2[nH]1)C(=O)NC1CC(C)(C)N(C)C(C)(C)C1
Show InChI InChI=1S/C24H31Cl2N3O2/c1-23(2)13-17(14-24(3,4)29(23)5)28-22(30)21(31-6)9-7-8-16-10-15-11-18(25)19(26)12-20(15)27-16/h7-12,17,27H,13-14H2,1-6H3,(H,28,30)/b8-7+,21-9+
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n/an/a 2.36E+3n/an/an/an/an/an/a



SmithKline Beecham Research Unit

Curated by ChEMBL


Assay Description
Compound was measured for the inhibition of bafilomycin-sensitive ATPase activity in partially purified membrane preparation from chicken osteoclast ...


Bioorg Med Chem Lett 8: 3621-6 (1999)


Article DOI: 10.1016/s0960-894x(98)00660-x
BindingDB Entry DOI: 10.7270/Q2R49PXM
More data for this
Ligand-Target Pair
Vacuolar ATP synthase subunit B, kidney isoform


(Homo sapiens (Human))
BDBM50064184
PNG
((2Z,4E)-5-(5,6-Dichloro-1H-indol-2-yl)-2-methoxy-p...)
Show SMILES CO\C(=C/C=C/c1cc2cc(Cl)c(Cl)cc2[nH]1)C(=O)NC1C[C@@H]2CC[C@H](C1)N2C
Show InChI InChI=1S/C22H25Cl2N3O2/c1-27-16-6-7-17(27)11-15(10-16)26-22(28)21(29-2)5-3-4-14-8-13-9-18(23)19(24)12-20(13)25-14/h3-5,8-9,12,15-17,25H,6-7,10-11H2,1-2H3,(H,26,28)/b4-3+,21-5-/t15?,16-,17+
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n/an/a 1.32E+3n/an/an/an/an/an/a



SmithKline Beecham S.p.A.

Curated by ChEMBL


Assay Description
Compound was tested for inhibititon of V-ATPase from human kidney cortex(hK)


J Med Chem 41: 1568-73 (1998)


Article DOI: 10.1021/jm9800144
BindingDB Entry DOI: 10.7270/Q2CJ8CM6
More data for this
Ligand-Target Pair
Potassium-transporting ATPase


(Sus scrofa (Pig))
BDBM50073331
PNG
((2Z,4Z)-5-(5,6-Dichloro-1H-indol-2-yl)-2-methoxy-p...)
Show SMILES CO\C(=C/C=C\c1cc2cc(Cl)c(Cl)cc2[nH]1)C(=O)NC1CC(C)(C)N(C)C(C)(C)C1
Show InChI InChI=1S/C24H31Cl2N3O2/c1-23(2)13-17(14-24(3,4)29(23)5)28-22(30)21(31-6)9-7-8-16-10-15-11-18(25)19(26)12-20(15)27-16/h7-12,17,27H,13-14H2,1-6H3,(H,28,30)/b8-7-,21-9-
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n/an/a 663n/an/an/an/an/an/a



SmithKline Beecham Research Unit

Curated by ChEMBL


Assay Description
Compound was measured for the inhibition of bafilomycin-sensitive ATPase activity in partially purified membrane preparation from chicken osteoclast ...


Bioorg Med Chem Lett 8: 3621-6 (1999)


Article DOI: 10.1016/s0960-894x(98)00660-x
BindingDB Entry DOI: 10.7270/Q2R49PXM
More data for this
Ligand-Target Pair
Potassium-transporting ATPase


(Sus scrofa (Pig))
BDBM50073332
PNG
((2Z,4E)-5-(5,6-Dichloro-1H-indol-2-yl)-2-methoxy-p...)
Show SMILES CO\C(=C/C=C/c1cc2cc(Cl)c(Cl)cc2[nH]1)C(=O)NC1CC(C)(C)N(C)C(C)(C)C1
Show InChI InChI=1S/C24H31Cl2N3O2/c1-23(2)13-17(14-24(3,4)29(23)5)28-22(30)21(31-6)9-7-8-16-10-15-11-18(25)19(26)12-20(15)27-16/h7-12,17,27H,13-14H2,1-6H3,(H,28,30)/b8-7+,21-9-
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n/an/a 27n/an/an/an/an/an/a



SmithKline Beecham Research Unit

Curated by ChEMBL


Assay Description
Compound was measured for the inhibition of bafilomycin-sensitive ATPase activity in partially purified membrane preparation from chicken osteoclast ...


Bioorg Med Chem Lett 8: 3621-6 (1999)


Article DOI: 10.1016/s0960-894x(98)00660-x
BindingDB Entry DOI: 10.7270/Q2R49PXM
More data for this
Ligand-Target Pair
Vacuolar ATP synthase subunit B, kidney isoform


(Homo sapiens (Human))
BDBM50064185
PNG
((2Z,4E)-5-(5,6-Dichloro-1H-indol-2-yl)-2-methoxy-p...)
Show SMILES CCN(CC)CCCNC(=O)C(\OC)=C\C=C\c1cc2cc(Cl)c(Cl)cc2[nH]1
Show InChI InChI=1S/C21H27Cl2N3O2/c1-4-26(5-2)11-7-10-24-21(27)20(28-3)9-6-8-16-12-15-13-17(22)18(23)14-19(15)25-16/h6,8-9,12-14,25H,4-5,7,10-11H2,1-3H3,(H,24,27)/b8-6+,20-9-
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n/an/a 3.00E+3n/an/an/an/an/an/a



SmithKline Beecham S.p.A.

Curated by ChEMBL


Assay Description
Compound was tested for inhibititon of V-ATPase from human kidney cortex(hK)


J Med Chem 41: 1568-73 (1998)


Article DOI: 10.1021/jm9800144
BindingDB Entry DOI: 10.7270/Q2CJ8CM6
More data for this
Ligand-Target Pair