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Compile Data Set for Download or QSAR

Found 414 hits Enz. Inhib. hit(s) with Target = 'Acidic mammalian chitinase' AND taxid = 9606   
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
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50554340
PNG
(CHEMBL4788866)
Show SMILES C[C@H]1CN([C@@H](Cc2ccc(Cl)cc2)CO1)C1CCN(CC1)c1nc(N)n[nH]1 |r|
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PubMed
4.80n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of full-length C-terminal his-tagged human AMCase expressed in CHO-K1 cells assessed as reduction in chitinolytic activity using 4-methylu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01179
BindingDB Entry DOI: 10.7270/Q2B85CS7
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50243745
PNG
(CHEMBL4076989)
Show SMILES CC(C)CN(CCc1ccc(Cl)cc1)C1CCN(CC1)c1nc(N)n[nH]1
Show InChI InChI=1S/C19H29ClN6/c1-14(2)13-26(10-7-15-3-5-16(20)6-4-15)17-8-11-25(12-9-17)19-22-18(21)23-24-19/h3-6,14,17H,7-13H2,1-2H3,(H3,21,22,23,24)
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Article
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14n/an/an/an/an/an/an/an/a



OncoArendi Therapeutics SA

Curated by ChEMBL


Assay Description
Inhibition of human recombinant full length C-terminal His-tagged acidic mammalian chitinase expressed in CHO-K1 cells using 4-methylumbelliferyl-bet...


J Med Chem 61: 695-710 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01051
BindingDB Entry DOI: 10.7270/Q2J105J5
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50541929
PNG
(CHEMBL1738785)
Show SMILES Cn1cnc2n(C)c(=O)n(CCCn3c(=O)n(C)c4[nH]cnc4c3=O)c(=O)c12
Show InChI InChI=1S/C16H18N8O4/c1-20-8-19-12-10(20)14(26)24(16(28)22(12)3)6-4-5-23-13(25)9-11(18-7-17-9)21(2)15(23)27/h7-8H,4-6H2,1-3H3,(H,17,18)
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260n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50587857
PNG
(CHEMBL5199149)
Show SMILES [Cl-].COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OC(=O)c1ccc(F)nc1
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350n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.bmc.2021.116143
BindingDB Entry DOI: 10.7270/Q28G8QN5
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM81509
PNG
(Bisdionin F)
Show SMILES Cn1cnc2n(C)c(=O)n(CCCn3c(=O)n(C)c4nc[nH]c4c3=O)c(=O)c12
Show InChI InChI=1S/C16H18N8O4/c1-20-8-19-12-10(20)14(26)24(16(28)22(12)3)6-4-5-23-13(25)9-11(18-7-17-9)21(2)15(23)27/h7-8H,4-6H2,1-3H3,(H,17,18)
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420 -37.9 920n/an/an/an/a5.237



University of Edinburgh



Assay Description
Chitnase inhibition by bisdionin compounds.


Chem Biol 18: 569-79 (2011)


Article DOI: 10.1016/j.chembiol.2011.02.017
BindingDB Entry DOI: 10.7270/Q28W3BSN
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5268683
PNG
PDB
MMDB

KEGG

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1.90E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5290508
PNG
PDB
MMDB

KEGG

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2.90E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5279325
PNG
PDB
MMDB

KEGG

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3.50E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5288210
PNG
PDB
MMDB

KEGG

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3.80E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50514508
PNG
(CHEMBL4549449)
Show SMILES CC(NC(=O)c1cc2c(nc3ccccn3c2=O)n(Cc2ccccc2)c1=N)c1ccccc1
Show InChI InChI=1S/C27H23N5O2/c1-18(20-12-6-3-7-13-20)29-26(33)21-16-22-25(30-23-14-8-9-15-31(23)27(22)34)32(24(21)28)17-19-10-4-2-5-11-19/h2-16,18,28H,17H2,1H3,(H,29,33)
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3.96E+3n/an/an/an/an/an/an/an/a



Dalian University of Technology

Curated by ChEMBL


Assay Description
Inhibition of human acidic mammalian chitinase catalytic domain overexpressed in Pichia pastoris using 4MU-(GlcNAc)2 as substrate after 30 mins by fl...


J Med Chem 63: 987-1001 (2020)


Article DOI: 10.1021/acs.jmedchem.9b01154
BindingDB Entry DOI: 10.7270/Q2N019W8
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5280316
PNG
PDB
MMDB

KEGG

UniProtKB/SwissProt

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UniChem
5.10E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5272737
PNG
PDB
MMDB

KEGG

UniProtKB/SwissProt

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5.30E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5289877
PNG
PDB
MMDB

KEGG

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5.60E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5267257
PNG
PDB
MMDB

KEGG

UniProtKB/SwissProt

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6.90E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5265903
PNG
PDB
MMDB

KEGG

UniProtKB/SwissProt

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UniChem
8.20E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5283905
PNG
PDB
MMDB

KEGG

UniProtKB/SwissProt

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UniChem
8.30E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50514507
PNG
(CHEMBL1583158)
Show SMILES Cc1cccn2c1nc1n(CC3CCCO3)c(=N)c(cc1c2=O)C(=O)NCc1cccnc1
Show InChI InChI=1S/C24H24N6O3/c1-15-5-3-9-29-21(15)28-22-19(24(29)32)11-18(20(25)30(22)14-17-7-4-10-33-17)23(31)27-13-16-6-2-8-26-12-16/h2-3,5-6,8-9,11-12,17,25H,4,7,10,13-14H2,1H3,(H,27,31)
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9.72E+3n/an/an/an/an/an/an/an/a



Dalian University of Technology

Curated by ChEMBL


Assay Description
Inhibition of human acidic mammalian chitinase catalytic domain overexpressed in Pichia pastoris using 4MU-(GlcNAc)2 as substrate after 30 mins by fl...


J Med Chem 63: 987-1001 (2020)


Article DOI: 10.1021/acs.jmedchem.9b01154
BindingDB Entry DOI: 10.7270/Q2N019W8
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5287414
PNG
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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UniChem
1.03E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5270387
PNG
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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UniChem
1.29E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50254171
PNG
(CHEMBL4069120)
Show SMILES CNC(=O)NC(=N)NCCCCCCCCN1CCCCCCOc2ccccc2CNC(=N)NC1=O
Show InChI InChI=1S/C26H44N8O3/c1-29-25(35)32-23(27)30-16-10-4-2-3-5-11-17-34-18-12-6-7-13-19-37-22-15-9-8-14-21(22)20-31-24(28)33-26(34)36/h8-9,14-15H,2-7,10-13,16-20H2,1H3,(H3,28,31,33,36)(H4,27,29,30,32,35)
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1.32E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5280623
PNG
PDB
MMDB

KEGG

UniProtKB/SwissProt

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1.80E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5283183
PNG
PDB
MMDB

KEGG

UniProtKB/SwissProt

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UniChem
1.84E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details
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Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5268303
PNG
PDB
MMDB

KEGG

UniProtKB/SwissProt

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UniChem
2.10E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5270383
PNG
PDB
MMDB

KEGG

UniProtKB/SwissProt

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UniChem
2.70E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5269695
PNG
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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UniChem
>5.00E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5272989
PNG
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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UniChem
>1.00E+5n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5279201
PNG
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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CHEMBL
UniChem
>1.00E+5n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5276418
PNG
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
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CHEMBL
UniChem
>1.00E+5n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
CHEMBL5286555
PNG
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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CHEMBL
UniChem
>1.00E+5n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50541950
PNG
(CHEMBL4643001)
Show SMILES CN1C[C@H](Cc2ccc(Cl)cc2)N(Cc2cc(Cl)ccc12)C1CCN(CC1)c1n[nH]c(N)n1 |r|
Show InChI InChI=1S/C24H29Cl2N7/c1-31-15-21(12-16-2-4-18(25)5-3-16)33(14-17-13-19(26)6-7-22(17)31)20-8-10-32(11-9-20)24-28-23(27)29-30-24/h2-7,13,20-21H,8-12,14-15H2,1H3,(H3,27,28,29,30)/t21-/m0/s1
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n/an/a 0.700n/an/an/an/an/an/a



OncoArendi Therapeutics S.A.

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant C-terminal His-tagged human acidic mammalian chitinase expressed in CHOK1 cells assessed as reduction in chitin...


ACS Med Chem Lett 11: 1228-1235 (2020)


Article DOI: 10.1021/acsmedchemlett.0c00092
BindingDB Entry DOI: 10.7270/Q2PV6PX3
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50541949
PNG
(CHEMBL4635305)
Show SMILES CN1C[C@H](Cc2ccc(Cl)cc2)N(Cc2ccccc12)C1CCN(CC1)c1n[nH]c(N)n1 |r|
Show InChI InChI=1S/C24H30ClN7/c1-30-16-21(14-17-6-8-19(25)9-7-17)32(15-18-4-2-3-5-22(18)30)20-10-12-31(13-11-20)24-27-23(26)28-29-24/h2-9,20-21H,10-16H2,1H3,(H3,26,27,28,29)/t21-/m0/s1
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n/an/a 1.40n/an/an/an/an/an/a



OncoArendi Therapeutics S.A.

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant C-terminal His-tagged human acidic mammalian chitinase expressed in CHOK1 cells assessed as reduction in chitin...


ACS Med Chem Lett 11: 1228-1235 (2020)


Article DOI: 10.1021/acsmedchemlett.0c00092
BindingDB Entry DOI: 10.7270/Q2PV6PX3
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50554344
PNG
(CHEMBL4756869)
Show SMILES CC(C)C[C@H]1CN([C@@H](Cc2ccc(Cl)cc2)CO1)C1CCN(CC1)c1nc(N)n[nH]1 |r|
PDB
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n/an/a 1.60n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of full-length C-terminal his-tagged human AMCase expressed in CHO-K1 cells assessed as reduction in chitinolytic activity using 4-methylu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01179
BindingDB Entry DOI: 10.7270/Q2B85CS7
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50541930
PNG
(CHEMBL4637417)
Show SMILES Nc1nc(n[nH]1)N1CCC(CC1)N(CCc1ccc(Cl)cc1)Cc1ccccc1O
Show InChI InChI=1S/C22H27ClN6O/c23-18-7-5-16(6-8-18)9-12-29(15-17-3-1-2-4-20(17)30)19-10-13-28(14-11-19)22-25-21(24)26-27-22/h1-8,19,30H,9-15H2,(H3,24,25,26,27)
PDB
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n/an/a 2n/an/an/an/an/an/a



OncoArendi Therapeutics S.A.

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant C-terminal His-tagged human acidic mammalian chitinase expressed in CHOK1 cells assessed as reduction in chitin...


ACS Med Chem Lett 11: 1228-1235 (2020)


Article DOI: 10.1021/acsmedchemlett.0c00092
BindingDB Entry DOI: 10.7270/Q2PV6PX3
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50541931
PNG
(CHEMBL4634943)
Show SMILES Nc1nc(n[nH]1)N1CCC(CC1)N(CCc1ccc(Cl)cc1)Cc1cccc(O)c1
Show InChI InChI=1S/C22H27ClN6O/c23-18-6-4-16(5-7-18)8-11-29(15-17-2-1-3-20(30)14-17)19-9-12-28(13-10-19)22-25-21(24)26-27-22/h1-7,14,19,30H,8-13,15H2,(H3,24,25,26,27)
PDB
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UniProtKB/SwissProt

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n/an/a 2n/an/an/an/an/an/a



OncoArendi Therapeutics S.A.

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant C-terminal His-tagged human acidic mammalian chitinase expressed in CHOK1 cells assessed as reduction in chitin...


ACS Med Chem Lett 11: 1228-1235 (2020)


Article DOI: 10.1021/acsmedchemlett.0c00092
BindingDB Entry DOI: 10.7270/Q2PV6PX3
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50243795
PNG
(CHEMBL4077644)
Show SMILES Nc1n[nH]c(n1)N1CCC(CC1)N(CCc1ccc(Cl)cc1)Cc1ccccc1Cl
Show InChI InChI=1S/C22H26Cl2N6/c23-18-7-5-16(6-8-18)9-12-30(15-17-3-1-2-4-20(17)24)19-10-13-29(14-11-19)22-26-21(25)27-28-22/h1-8,19H,9-15H2,(H3,25,26,27,28)
PDB
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OncoArendi Therapeutics S.A.

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant C-terminal His-tagged human acidic mammalian chitinase expressed in CHOK1 cells assessed as reduction in chitin...


ACS Med Chem Lett 11: 1228-1235 (2020)


Article DOI: 10.1021/acsmedchemlett.0c00092
BindingDB Entry DOI: 10.7270/Q2PV6PX3
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50554343
PNG
(CHEMBL4794014)
Show SMILES CC(C)[C@H]1CN([C@@H](Cc2ccc(Cl)cc2)CO1)C1CCN(CC1)c1nc(N)n[nH]1 |r|
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TBA

Assay Description
Inhibition of full-length C-terminal his-tagged human AMCase expressed in CHO-K1 cells assessed as reduction in chitinolytic activity using 4-methylu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01179
BindingDB Entry DOI: 10.7270/Q2B85CS7
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50243685
PNG
(CHEMBL4084573)
Show SMILES Nc1n[nH]c(n1)N1CCC(CC1)N(CCc1ccc(Cl)cc1)Cc1cccc2ccccc12
Show InChI InChI=1S/C26H29ClN6/c27-22-10-8-19(9-11-22)12-15-33(18-21-6-3-5-20-4-1-2-7-24(20)21)23-13-16-32(17-14-23)26-29-25(28)30-31-26/h1-11,23H,12-18H2,(H3,28,29,30,31)
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OncoArendi Therapeutics SA

Curated by ChEMBL


Assay Description
Inhibition of human recombinant full length C-terminal His-tagged acidic mammalian chitinase expressed in CHO-K1 cells using 4-methylumbelliferyl-bet...


J Med Chem 61: 695-710 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01051
BindingDB Entry DOI: 10.7270/Q2J105J5
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50243795
PNG
(CHEMBL4077644)
Show SMILES Nc1n[nH]c(n1)N1CCC(CC1)N(CCc1ccc(Cl)cc1)Cc1ccccc1Cl
Show InChI InChI=1S/C22H26Cl2N6/c23-18-7-5-16(6-8-18)9-12-30(15-17-3-1-2-4-20(17)24)19-10-13-29(14-11-19)22-26-21(25)27-28-22/h1-8,19H,9-15H2,(H3,25,26,27,28)
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OncoArendi Therapeutics SA

Curated by ChEMBL


Assay Description
Inhibition of human recombinant full length C-terminal His-tagged acidic mammalian chitinase expressed in CHO-K1 cells using 4-methylumbelliferyl-bet...


J Med Chem 61: 695-710 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01051
BindingDB Entry DOI: 10.7270/Q2J105J5
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50541933
PNG
(CHEMBL4646309)
Show SMILES Nc1nc(n[nH]1)N1CCC(CC1)N(CCc1ccc(Cl)cc1)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C22H26Cl2N6/c23-18-5-1-16(2-6-18)9-12-30(15-17-3-7-19(24)8-4-17)20-10-13-29(14-11-20)22-26-21(25)27-28-22/h1-8,20H,9-15H2,(H3,25,26,27,28)
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OncoArendi Therapeutics S.A.

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant C-terminal His-tagged human acidic mammalian chitinase expressed in CHOK1 cells assessed as reduction in chitin...


ACS Med Chem Lett 11: 1228-1235 (2020)


Article DOI: 10.1021/acsmedchemlett.0c00092
BindingDB Entry DOI: 10.7270/Q2PV6PX3
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50243799
PNG
(CHEMBL4077482)
Show SMILES Nc1n[nH]c(n1)N1CCC(CC1)N(CCc1ccc(Cl)cc1)Cc1ccccc1
Show InChI InChI=1S/C22H27ClN6/c23-19-8-6-17(7-9-19)10-13-29(16-18-4-2-1-3-5-18)20-11-14-28(15-12-20)22-25-21(24)26-27-22/h1-9,20H,10-16H2,(H3,24,25,26,27)
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OncoArendi Therapeutics S.A.

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant C-terminal His-tagged human acidic mammalian chitinase expressed in CHOK1 cells assessed as reduction in chitin...


ACS Med Chem Lett 11: 1228-1235 (2020)


Article DOI: 10.1021/acsmedchemlett.0c00092
BindingDB Entry DOI: 10.7270/Q2PV6PX3
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50541934
PNG
(CHEMBL4632547)
Show SMILES Nc1nc(n[nH]1)N1CCC(CC1)N(CCc1ccc(Cl)cc1)Cc1ccc(F)cc1Cl
Show InChI InChI=1S/C22H25Cl2FN6/c23-17-4-1-15(2-5-17)7-10-31(14-16-3-6-18(25)13-20(16)24)19-8-11-30(12-9-19)22-27-21(26)28-29-22/h1-6,13,19H,7-12,14H2,(H3,26,27,28,29)
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OncoArendi Therapeutics S.A.

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant C-terminal His-tagged human acidic mammalian chitinase expressed in CHOK1 cells assessed as reduction in chitin...


ACS Med Chem Lett 11: 1228-1235 (2020)


Article DOI: 10.1021/acsmedchemlett.0c00092
BindingDB Entry DOI: 10.7270/Q2PV6PX3
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50541936
PNG
(CHEMBL4646247)
Show SMILES Nc1nc(n[nH]1)N1CCC(CC1)N(CCc1ccc(Cl)cc1)Cc1cc(F)ccc1F
Show InChI InChI=1S/C22H25ClF2N6/c23-17-3-1-15(2-4-17)7-10-31(14-16-13-18(24)5-6-20(16)25)19-8-11-30(12-9-19)22-27-21(26)28-29-22/h1-6,13,19H,7-12,14H2,(H3,26,27,28,29)
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OncoArendi Therapeutics S.A.

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant C-terminal His-tagged human acidic mammalian chitinase expressed in CHOK1 cells assessed as reduction in chitin...


ACS Med Chem Lett 11: 1228-1235 (2020)


Article DOI: 10.1021/acsmedchemlett.0c00092
BindingDB Entry DOI: 10.7270/Q2PV6PX3
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50243799
PNG
(CHEMBL4077482)
Show SMILES Nc1n[nH]c(n1)N1CCC(CC1)N(CCc1ccc(Cl)cc1)Cc1ccccc1
Show InChI InChI=1S/C22H27ClN6/c23-19-8-6-17(7-9-19)10-13-29(16-18-4-2-1-3-5-18)20-11-14-28(15-12-20)22-25-21(24)26-27-22/h1-9,20H,10-16H2,(H3,24,25,26,27)
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OncoArendi Therapeutics SA

Curated by ChEMBL


Assay Description
Inhibition of human recombinant full length C-terminal His-tagged acidic mammalian chitinase expressed in CHO-K1 cells using 4-methylumbelliferyl-bet...


J Med Chem 61: 695-710 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01051
BindingDB Entry DOI: 10.7270/Q2J105J5
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50541932
PNG
(CHEMBL4649081)
Show SMILES Nc1nc(n[nH]1)N1CCC(CC1)N(CCc1ccc(Cl)cc1)Cc1cccc(Cl)c1
Show InChI InChI=1S/C22H26Cl2N6/c23-18-6-4-16(5-7-18)8-11-30(15-17-2-1-3-19(24)14-17)20-9-12-29(13-10-20)22-26-21(25)27-28-22/h1-7,14,20H,8-13,15H2,(H3,25,26,27,28)
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OncoArendi Therapeutics S.A.

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant C-terminal His-tagged human acidic mammalian chitinase expressed in CHOK1 cells assessed as reduction in chitin...


ACS Med Chem Lett 11: 1228-1235 (2020)


Article DOI: 10.1021/acsmedchemlett.0c00092
BindingDB Entry DOI: 10.7270/Q2PV6PX3
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50554345
PNG
(CHEMBL4789376)
Show SMILES Nc1n[nH]c(n1)N1CCC(CC1)N1C[C@H](CO)OC[C@@H]1Cc1ccc(Cl)cc1 |r|
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TBA

Assay Description
Inhibition of full-length C-terminal his-tagged human AMCase expressed in CHO-K1 cells assessed as reduction in chitinolytic activity using 4-methylu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01179
BindingDB Entry DOI: 10.7270/Q2B85CS7
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50554346
PNG
(CHEMBL4764430)
Show SMILES CC(C)(O)[C@H]1CN([C@@H](Cc2ccc(Cl)cc2)CO1)C1CCN(CC1)c1nc(N)n[nH]1 |r|
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TBA

Assay Description
Inhibition of full-length C-terminal his-tagged human AMCase expressed in CHO-K1 cells assessed as reduction in chitinolytic activity using 4-methylu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01179
BindingDB Entry DOI: 10.7270/Q2B85CS7
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50541938
PNG
(CHEMBL4640857)
Show SMILES Nc1nc(n[nH]1)N1CCC(CC1)N1Cc2ccccc2OC[C@@H]1Cc1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C23H27ClN6O/c24-18-7-5-16(6-8-18)13-20-15-31-21-4-2-1-3-17(21)14-30(20)19-9-11-29(12-10-19)23-26-22(25)27-28-23/h1-8,19-20H,9-15H2,(H3,25,26,27,28)/t20-/m0/s1
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TBA

Assay Description
Inhibition of full-length C-terminal his-tagged human AMCase expressed in CHO-K1 cells assessed as reduction in chitinolytic activity using 4-methylu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01179
BindingDB Entry DOI: 10.7270/Q2B85CS7
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50541939
PNG
(CHEMBL4648962)
Show SMILES Nc1nc(n[nH]1)N1CCC(CC1)N1Cc2cc(F)ccc2OC[C@@H]1Cc1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C23H26ClFN6O/c24-17-3-1-15(2-4-17)11-20-14-32-21-6-5-18(25)12-16(21)13-31(20)19-7-9-30(10-8-19)23-27-22(26)28-29-23/h1-6,12,19-20H,7-11,13-14H2,(H3,26,27,28,29)/t20-/m0/s1
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OncoArendi Therapeutics S.A.

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant C-terminal His-tagged human acidic mammalian chitinase expressed in CHOK1 cells assessed as reduction in chitin...


ACS Med Chem Lett 11: 1228-1235 (2020)


Article DOI: 10.1021/acsmedchemlett.0c00092
BindingDB Entry DOI: 10.7270/Q2PV6PX3
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50541938
PNG
(CHEMBL4640857)
Show SMILES Nc1nc(n[nH]1)N1CCC(CC1)N1Cc2ccccc2OC[C@@H]1Cc1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C23H27ClN6O/c24-18-7-5-16(6-8-18)13-20-15-31-21-4-2-1-3-17(21)14-30(20)19-9-11-29(12-10-19)23-26-22(25)27-28-23/h1-8,19-20H,9-15H2,(H3,25,26,27,28)/t20-/m0/s1
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OncoArendi Therapeutics S.A.

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant C-terminal His-tagged human acidic mammalian chitinase expressed in CHOK1 cells assessed as reduction in chitin...


ACS Med Chem Lett 11: 1228-1235 (2020)


Article DOI: 10.1021/acsmedchemlett.0c00092
BindingDB Entry DOI: 10.7270/Q2PV6PX3
More data for this
Ligand-Target Pair
Acidic mammalian chitinase


(Homo sapiens (Human))
BDBM50541940
PNG
(CHEMBL4638897)
Show SMILES Nc1nc(n[nH]1)N1CCC(CC1)N1Cc2cc(Cl)ccc2OC[C@@H]1Cc1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C23H26Cl2N6O/c24-17-3-1-15(2-4-17)11-20-14-32-21-6-5-18(25)12-16(21)13-31(20)19-7-9-30(10-8-19)23-27-22(26)28-29-23/h1-6,12,19-20H,7-11,13-14H2,(H3,26,27,28,29)/t20-/m0/s1
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OncoArendi Therapeutics S.A.

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant C-terminal His-tagged human acidic mammalian chitinase expressed in CHOK1 cells assessed as reduction in chitin...


ACS Med Chem Lett 11: 1228-1235 (2020)


Article DOI: 10.1021/acsmedchemlett.0c00092
BindingDB Entry DOI: 10.7270/Q2PV6PX3
More data for this
Ligand-Target Pair
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