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Found 24 hits with Last Name = 'mannochio de souza russo' and Initial = 'e'   
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
Metallothionein-2


(Human)
BDBM50035179
PNG
(Agomelatine | CHEMBL10878 | N-[2-(7-Methoxy-naphth...)
Show SMILES COc1ccc2cccc(CCNC(C)=O)c2c1
Show InChI InChI=1S/C15H17NO2/c1-11(17)16-9-8-13-5-3-4-12-6-7-14(18-2)10-15(12)13/h3-7,10H,8-9H2,1-2H3,(H,16,17)
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0.0420n/an/an/an/an/an/an/an/a



ACHÉ LABORATÓRIOS FARMACÊUTICOS S.A.

US Patent


Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


US Patent US10781182 (2020)


BindingDB Entry DOI: 10.7270/Q2JH3Q7Q
More data for this
Ligand-Target Pair
Melatonin receptor type 1B


(Homo sapiens (Human))
BDBM50035179
PNG
(Agomelatine | CHEMBL10878 | N-[2-(7-Methoxy-naphth...)
Show SMILES COc1ccc2cccc(CCNC(C)=O)c2c1
Show InChI InChI=1S/C15H17NO2/c1-11(17)16-9-8-13-5-3-4-12-6-7-14(18-2)10-15(12)13/h3-7,10H,8-9H2,1-2H3,(H,16,17)
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0.0420n/an/an/an/an/an/an/an/a


TBA

Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


Citation and Details

BindingDB Entry DOI: 10.7270/Q24Q7Z44
More data for this
Ligand-Target Pair
Melatonin receptor type 1A


(Homo sapiens (Human))
BDBM50035179
PNG
(Agomelatine | CHEMBL10878 | N-[2-(7-Methoxy-naphth...)
Show SMILES COc1ccc2cccc(CCNC(C)=O)c2c1
Show InChI InChI=1S/C15H17NO2/c1-11(17)16-9-8-13-5-3-4-12-6-7-14(18-2)10-15(12)13/h3-7,10H,8-9H2,1-2H3,(H,16,17)
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0.200n/an/an/an/an/an/an/an/a


TBA

Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


Citation and Details

BindingDB Entry DOI: 10.7270/Q24Q7Z44
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Melatonin receptor type 1A


(Homo sapiens (Human))
BDBM50035179
PNG
(Agomelatine | CHEMBL10878 | N-[2-(7-Methoxy-naphth...)
Show SMILES COc1ccc2cccc(CCNC(C)=O)c2c1
Show InChI InChI=1S/C15H17NO2/c1-11(17)16-9-8-13-5-3-4-12-6-7-14(18-2)10-15(12)13/h3-7,10H,8-9H2,1-2H3,(H,16,17)
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0.200n/an/an/an/an/an/an/an/a



ACHÉ LABORATÓRIOS FARMACÊUTICOS S.A.

US Patent


Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


US Patent US10781182 (2020)


BindingDB Entry DOI: 10.7270/Q2JH3Q7Q
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Melatonin receptor type 1B


(Homo sapiens (Human))
BDBM463447
PNG
(US10781182, Compound IA2-143 | US11091445, Compoun...)
Show SMILES COc1nc2cc(Cl)c(OC)cc2n1CCNC(C)=O
Show InChI InChI=1S/C13H16ClN3O3/c1-8(18)15-4-5-17-11-7-12(19-2)9(14)6-10(11)16-13(17)20-3/h6-7H,4-5H2,1-3H3,(H,15,18)
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0.800n/an/an/an/an/an/an/an/a


TBA

Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


Citation and Details

BindingDB Entry DOI: 10.7270/Q24Q7Z44
More data for this
Ligand-Target Pair
Metallothionein-2


(Human)
BDBM463447
PNG
(US10781182, Compound IA2-143 | US11091445, Compoun...)
Show SMILES COc1nc2cc(Cl)c(OC)cc2n1CCNC(C)=O
Show InChI InChI=1S/C13H16ClN3O3/c1-8(18)15-4-5-17-11-7-12(19-2)9(14)6-10(11)16-13(17)20-3/h6-7H,4-5H2,1-3H3,(H,15,18)
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0.800n/an/an/an/an/an/an/an/a



ACHÉ LABORATÓRIOS FARMACÊUTICOS S.A.

US Patent


Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


US Patent US10781182 (2020)


BindingDB Entry DOI: 10.7270/Q2JH3Q7Q
More data for this
Ligand-Target Pair
Melatonin receptor type 1A


(Homo sapiens (Human))
BDBM463444
PNG
(US10781182, Compound IA2-121 | US11091445, Compoun...)
Show SMILES CCOc1nc2cc(Cl)c(OC)cc2n1CCNC(C)=O
Show InChI InChI=1S/C14H18ClN3O3/c1-4-21-14-17-11-7-10(15)13(20-3)8-12(11)18(14)6-5-16-9(2)19/h7-8H,4-6H2,1-3H3,(H,16,19)
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0.880n/an/an/an/an/an/an/an/a


TBA

Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


Citation and Details

BindingDB Entry DOI: 10.7270/Q24Q7Z44
More data for this
Ligand-Target Pair
Melatonin receptor type 1A


(Homo sapiens (Human))
BDBM463444
PNG
(US10781182, Compound IA2-121 | US11091445, Compoun...)
Show SMILES CCOc1nc2cc(Cl)c(OC)cc2n1CCNC(C)=O
Show InChI InChI=1S/C14H18ClN3O3/c1-4-21-14-17-11-7-10(15)13(20-3)8-12(11)18(14)6-5-16-9(2)19/h7-8H,4-6H2,1-3H3,(H,16,19)
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0.880n/an/an/an/an/an/an/an/a



ACHÉ LABORATÓRIOS FARMACÊUTICOS S.A.

US Patent


Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


US Patent US10781182 (2020)


BindingDB Entry DOI: 10.7270/Q2JH3Q7Q
More data for this
Ligand-Target Pair
Melatonin receptor type 1B


(Homo sapiens (Human))
BDBM463444
PNG
(US10781182, Compound IA2-121 | US11091445, Compoun...)
Show SMILES CCOc1nc2cc(Cl)c(OC)cc2n1CCNC(C)=O
Show InChI InChI=1S/C14H18ClN3O3/c1-4-21-14-17-11-7-10(15)13(20-3)8-12(11)18(14)6-5-16-9(2)19/h7-8H,4-6H2,1-3H3,(H,16,19)
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0.930n/an/an/an/an/an/an/an/a


TBA

Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


Citation and Details

BindingDB Entry DOI: 10.7270/Q24Q7Z44
More data for this
Ligand-Target Pair
Metallothionein-2


(Human)
BDBM463444
PNG
(US10781182, Compound IA2-121 | US11091445, Compoun...)
Show SMILES CCOc1nc2cc(Cl)c(OC)cc2n1CCNC(C)=O
Show InChI InChI=1S/C14H18ClN3O3/c1-4-21-14-17-11-7-10(15)13(20-3)8-12(11)18(14)6-5-16-9(2)19/h7-8H,4-6H2,1-3H3,(H,16,19)
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0.930n/an/an/an/an/an/an/an/a



ACHÉ LABORATÓRIOS FARMACÊUTICOS S.A.

US Patent


Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


US Patent US10781182 (2020)


BindingDB Entry DOI: 10.7270/Q2JH3Q7Q
More data for this
Ligand-Target Pair
Melatonin receptor type 1A


(Homo sapiens (Human))
BDBM463443
PNG
(US10781182, Compound IA2-120 | US11091445, Compoun...)
Show SMILES CCOc1nc2ccc(OC)cc2n1CCCNC(C)=O
Show InChI InChI=1S/C15H21N3O3/c1-4-21-15-17-13-7-6-12(20-3)10-14(13)18(15)9-5-8-16-11(2)19/h6-7,10H,4-5,8-9H2,1-3H3,(H,16,19)
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1.10n/an/an/an/an/an/an/an/a



ACHÉ LABORATÓRIOS FARMACÊUTICOS S.A.

US Patent


Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


US Patent US10781182 (2020)


BindingDB Entry DOI: 10.7270/Q2JH3Q7Q
More data for this
Ligand-Target Pair
Melatonin receptor type 1A


(Homo sapiens (Human))
BDBM463443
PNG
(US10781182, Compound IA2-120 | US11091445, Compoun...)
Show SMILES CCOc1nc2ccc(OC)cc2n1CCCNC(C)=O
Show InChI InChI=1S/C15H21N3O3/c1-4-21-15-17-13-7-6-12(20-3)10-14(13)18(15)9-5-8-16-11(2)19/h6-7,10H,4-5,8-9H2,1-3H3,(H,16,19)
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1.10n/an/an/an/an/an/an/an/a


TBA

Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


Citation and Details

BindingDB Entry DOI: 10.7270/Q24Q7Z44
More data for this
Ligand-Target Pair
Melatonin receptor type 1B


(Homo sapiens (Human))
BDBM463446
PNG
(US10781182, Compound IA2-142 | US11091445, Compoun...)
Show SMILES CCOc1nc2cc(Cl)c(OC)cc2n1CCCNC(C)=O
Show InChI InChI=1S/C15H20ClN3O3/c1-4-22-15-18-12-8-11(16)14(21-3)9-13(12)19(15)7-5-6-17-10(2)20/h8-9H,4-7H2,1-3H3,(H,17,20)
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1.60n/an/an/an/an/an/an/an/a


TBA

Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


Citation and Details

BindingDB Entry DOI: 10.7270/Q24Q7Z44
More data for this
Ligand-Target Pair
Metallothionein-2


(Human)
BDBM463446
PNG
(US10781182, Compound IA2-142 | US11091445, Compoun...)
Show SMILES CCOc1nc2cc(Cl)c(OC)cc2n1CCCNC(C)=O
Show InChI InChI=1S/C15H20ClN3O3/c1-4-22-15-18-12-8-11(16)14(21-3)9-13(12)19(15)7-5-6-17-10(2)20/h8-9H,4-7H2,1-3H3,(H,17,20)
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1.60n/an/an/an/an/an/an/an/a



ACHÉ LABORATÓRIOS FARMACÊUTICOS S.A.

US Patent


Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


US Patent US10781182 (2020)


BindingDB Entry DOI: 10.7270/Q2JH3Q7Q
More data for this
Ligand-Target Pair
Melatonin receptor type 1A


(Homo sapiens (Human))
BDBM463447
PNG
(US10781182, Compound IA2-143 | US11091445, Compoun...)
Show SMILES COc1nc2cc(Cl)c(OC)cc2n1CCNC(C)=O
Show InChI InChI=1S/C13H16ClN3O3/c1-8(18)15-4-5-17-11-7-12(19-2)9(14)6-10(11)16-13(17)20-3/h6-7H,4-5H2,1-3H3,(H,15,18)
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2.10n/an/an/an/an/an/an/an/a


TBA

Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


Citation and Details

BindingDB Entry DOI: 10.7270/Q24Q7Z44
More data for this
Ligand-Target Pair
Melatonin receptor type 1A


(Homo sapiens (Human))
BDBM463447
PNG
(US10781182, Compound IA2-143 | US11091445, Compoun...)
Show SMILES COc1nc2cc(Cl)c(OC)cc2n1CCNC(C)=O
Show InChI InChI=1S/C13H16ClN3O3/c1-8(18)15-4-5-17-11-7-12(19-2)9(14)6-10(11)16-13(17)20-3/h6-7H,4-5H2,1-3H3,(H,15,18)
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2.10n/an/an/an/an/an/an/an/a



ACHÉ LABORATÓRIOS FARMACÊUTICOS S.A.

US Patent


Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


US Patent US10781182 (2020)


BindingDB Entry DOI: 10.7270/Q2JH3Q7Q
More data for this
Ligand-Target Pair
Melatonin receptor type 1A


(Homo sapiens (Human))
BDBM463445
PNG
(US10781182, Compound IA2-140 | US11091445, Compoun...)
Show SMILES COc1nc2ccc(OC)cc2n1CCCNC(C)=O
Show InChI InChI=1S/C14H19N3O3/c1-10(18)15-7-4-8-17-13-9-11(19-2)5-6-12(13)16-14(17)20-3/h5-6,9H,4,7-8H2,1-3H3,(H,15,18)
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2.20n/an/an/an/an/an/an/an/a


TBA

Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


Citation and Details

BindingDB Entry DOI: 10.7270/Q24Q7Z44
More data for this
Ligand-Target Pair
Melatonin receptor type 1A


(Homo sapiens (Human))
BDBM463445
PNG
(US10781182, Compound IA2-140 | US11091445, Compoun...)
Show SMILES COc1nc2ccc(OC)cc2n1CCCNC(C)=O
Show InChI InChI=1S/C14H19N3O3/c1-10(18)15-7-4-8-17-13-9-11(19-2)5-6-12(13)16-14(17)20-3/h5-6,9H,4,7-8H2,1-3H3,(H,15,18)
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2.20n/an/an/an/an/an/an/an/a



ACHÉ LABORATÓRIOS FARMACÊUTICOS S.A.

US Patent


Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


US Patent US10781182 (2020)


BindingDB Entry DOI: 10.7270/Q2JH3Q7Q
More data for this
Ligand-Target Pair
Melatonin receptor type 1B


(Homo sapiens (Human))
BDBM463443
PNG
(US10781182, Compound IA2-120 | US11091445, Compoun...)
Show SMILES CCOc1nc2ccc(OC)cc2n1CCCNC(C)=O
Show InChI InChI=1S/C15H21N3O3/c1-4-21-15-17-13-7-6-12(20-3)10-14(13)18(15)9-5-8-16-11(2)19/h6-7,10H,4-5,8-9H2,1-3H3,(H,16,19)
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4.5n/an/an/an/an/an/an/an/a


TBA

Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


Citation and Details

BindingDB Entry DOI: 10.7270/Q24Q7Z44
More data for this
Ligand-Target Pair
Metallothionein-2


(Human)
BDBM463443
PNG
(US10781182, Compound IA2-120 | US11091445, Compoun...)
Show SMILES CCOc1nc2ccc(OC)cc2n1CCCNC(C)=O
Show InChI InChI=1S/C15H21N3O3/c1-4-21-15-17-13-7-6-12(20-3)10-14(13)18(15)9-5-8-16-11(2)19/h6-7,10H,4-5,8-9H2,1-3H3,(H,16,19)
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4.5n/an/an/an/an/an/an/an/a



ACHÉ LABORATÓRIOS FARMACÊUTICOS S.A.

US Patent


Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


US Patent US10781182 (2020)


BindingDB Entry DOI: 10.7270/Q2JH3Q7Q
More data for this
Ligand-Target Pair
Metallothionein-2


(Human)
BDBM463445
PNG
(US10781182, Compound IA2-140 | US11091445, Compoun...)
Show SMILES COc1nc2ccc(OC)cc2n1CCCNC(C)=O
Show InChI InChI=1S/C14H19N3O3/c1-10(18)15-7-4-8-17-13-9-11(19-2)5-6-12(13)16-14(17)20-3/h5-6,9H,4,7-8H2,1-3H3,(H,15,18)
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11n/an/an/an/an/an/an/an/a



ACHÉ LABORATÓRIOS FARMACÊUTICOS S.A.

US Patent


Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


US Patent US10781182 (2020)


BindingDB Entry DOI: 10.7270/Q2JH3Q7Q
More data for this
Ligand-Target Pair
Melatonin receptor type 1B


(Homo sapiens (Human))
BDBM463445
PNG
(US10781182, Compound IA2-140 | US11091445, Compoun...)
Show SMILES COc1nc2ccc(OC)cc2n1CCCNC(C)=O
Show InChI InChI=1S/C14H19N3O3/c1-10(18)15-7-4-8-17-13-9-11(19-2)5-6-12(13)16-14(17)20-3/h5-6,9H,4,7-8H2,1-3H3,(H,15,18)
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11n/an/an/an/an/an/an/an/a


TBA

Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


Citation and Details

BindingDB Entry DOI: 10.7270/Q24Q7Z44
More data for this
Ligand-Target Pair
Melatonin receptor type 1A


(Homo sapiens (Human))
BDBM463446
PNG
(US10781182, Compound IA2-142 | US11091445, Compoun...)
Show SMILES CCOc1nc2cc(Cl)c(OC)cc2n1CCCNC(C)=O
Show InChI InChI=1S/C15H20ClN3O3/c1-4-22-15-18-12-8-11(16)14(21-3)9-13(12)19(15)7-5-6-17-10(2)20/h8-9H,4-7H2,1-3H3,(H,17,20)
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13n/an/an/an/an/an/an/an/a


TBA

Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


Citation and Details

BindingDB Entry DOI: 10.7270/Q24Q7Z44
More data for this
Ligand-Target Pair
Melatonin receptor type 1A


(Homo sapiens (Human))
BDBM463446
PNG
(US10781182, Compound IA2-142 | US11091445, Compoun...)
Show SMILES CCOc1nc2cc(Cl)c(OC)cc2n1CCCNC(C)=O
Show InChI InChI=1S/C15H20ClN3O3/c1-4-22-15-18-12-8-11(16)14(21-3)9-13(12)19(15)7-5-6-17-10(2)20/h8-9H,4-7H2,1-3H3,(H,17,20)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
13n/an/an/an/an/an/an/an/a



ACHÉ LABORATÓRIOS FARMACÊUTICOS S.A.

US Patent


Assay Description
The binding assay was performed in melatonergic MT1 and MT2 receptors in order to check the receptor affinity for the ligand, i.e., the ability of th...


US Patent US10781182 (2020)


BindingDB Entry DOI: 10.7270/Q2JH3Q7Q
More data for this
Ligand-Target Pair