BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 14 hits with Last Name = 'sun' and Initial = 'qy'   
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
Acetylcholinesterase


(Homo sapiens (Human))		BDBM50221070
PNG
(CHEMBL1524 | Sanguinine)
Show SMILES CN1CC[C@@]23C=C[C@H](O)C[C@@H]2Oc2c3c(C1)ccc2O |c:5|
Show InChI InChI=1S/C16H19NO3/c1-17-7-6-16-5-4-11(18)8-13(16)20-15-12(19)3-2-10(9-17)14(15)16/h2-5,11,13,18-19H,6-9H2,1H3/t11-,13-,16-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
KEGG
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 100n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of AChE by Ellman method

J Nat Prod 70: 1458-61 (2007)


Article DOI: 10.1021/np0702077
BindingDB Entry DOI: 10.7270/Q2MK6DQQ
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))		BDBM8961
PNG
(1,2,3,4-tetrahydro-9-acridinamine | 1,2,3,4-tetrah...)
Show SMILES Nc1c2CCCCc2nc2ccccc12
Show InChI InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents

Similars
PDB
Article
PubMed
n/an/a 200n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human AChE by Ellman's assay

J Nat Prod 72: 1151-4 (2009)


Article DOI: 10.1021/np9001515
BindingDB Entry DOI: 10.7270/Q22807ND
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Acetylcholinesterase


(Homo sapiens (Human))		BDBM8961
PNG
(1,2,3,4-tetrahydro-9-acridinamine | 1,2,3,4-tetrah...)
Show SMILES Nc1c2CCCCc2nc2ccccc12
Show InChI InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents

Similars
PDB
Article
PubMed
n/an/a 200n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of AChE by Ellman method

J Nat Prod 70: 1458-61 (2007)


Article DOI: 10.1021/np0702077
BindingDB Entry DOI: 10.7270/Q2MK6DQQ
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Acetylcholinesterase


(Homo sapiens (Human))		BDBM50221063
PNG
((1S,2S,12bS,12cS)-1,2-Diol-2,4,5,7, 12b,12c-hexahy...)
Show SMILES CC(=O)O[C@@H]1[C@@H](O)C=C2CCN3Cc4cc5OCOc5cc4[C@H]1[C@@H]23 |r,t:7|
Show InChI InChI=1S/C18H19NO5/c1-9(20)24-18-13(21)4-10-2-3-19-7-11-5-14-15(23-8-22-14)6-12(11)16(18)17(10)19/h4-6,13,16-18,21H,2-3,7-8H2,1H3/t13-,16-,17+,18+/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 960n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of AChE by Ellman method

J Nat Prod 70: 1458-61 (2007)


Article DOI: 10.1021/np0702077
BindingDB Entry DOI: 10.7270/Q2MK6DQQ
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))		BDBM10404
PNG
((1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetrac...)
Show SMILES COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 |r,c:12|
Show InChI InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents

Similars
DrugBank
PDB
Article
PubMed
n/an/a 1.07E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of AChE by Ellman method

J Nat Prod 70: 1458-61 (2007)


Article DOI: 10.1021/np0702077
BindingDB Entry DOI: 10.7270/Q2MK6DQQ
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Acetylcholinesterase


(Homo sapiens (Human))		BDBM50221061
PNG
(CHEMBL1523 | norsanguinine)
Show SMILES O[C@@H]1C[C@@H]2Oc3c4c(CNCC[C@@]24C=C1)ccc3O |c:15|
Show InChI InChI=1S/C15H17NO3/c17-10-3-4-15-5-6-16-8-9-1-2-11(18)14(13(9)15)19-12(15)7-10/h1-4,10,12,16-18H,5-8H2/t10-,12-,15-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 1.43E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of AChE by Ellman method

J Nat Prod 70: 1458-61 (2007)


Article DOI: 10.1021/np0702077
BindingDB Entry DOI: 10.7270/Q2MK6DQQ
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))		BDBM50221068
PNG
(11-Hydroxygalantamine | CHEMBL409610)
Show SMILES COc1ccc2CN(C)C[C@@H](O)[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 |c:13|
Show InChI InChI=1S/C17H21NO4/c1-18-8-10-3-4-12(21-2)16-15(10)17(13(20)9-18)6-5-11(19)7-14(17)22-16/h3-6,11,13-14,19-20H,7-9H2,1-2H3/t11-,13+,14-,17-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.61E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of AChE by Ellman method

J Nat Prod 70: 1458-61 (2007)


Article DOI: 10.1021/np0702077
BindingDB Entry DOI: 10.7270/Q2MK6DQQ
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))		BDBM50221065
PNG
(8-demethoxy-10-O-methylhostasine | CHEMBL252723)
Show SMILES COc1cc2C(=O)O[C@@]3([C@@H]4N(C)CCC4=C[C@H](O)[C@H]3O)c2cc1OC |c:15|
Show InChI InChI=1S/C18H21NO6/c1-19-5-4-9-6-12(20)16(21)18(15(9)19)11-8-14(24-3)13(23-2)7-10(11)17(22)25-18/h6-8,12,15-16,20-21H,4-5H2,1-3H3/t12-,15+,16+,18+/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 2.32E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of AChE by Ellman method

J Nat Prod 70: 1458-61 (2007)


Article DOI: 10.1021/np0702077
BindingDB Entry DOI: 10.7270/Q2MK6DQQ
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))		BDBM50358566
PNG
(UNGEREMINE)
Show SMILES [O-]c1cc2CC[n+]3cc4cc5OCOc5cc4c(c1)c23
Show InChI InChI=1S/C16H11NO3/c18-11-3-9-1-2-17-7-10-4-14-15(20-8-19-14)6-12(10)13(5-11)16(9)17/h3-7H,1-2,8H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

KEGG
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 3.85E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of AChE by Ellman method

J Nat Prod 70: 1458-61 (2007)


Article DOI: 10.1021/np0702077
BindingDB Entry DOI: 10.7270/Q2MK6DQQ
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))		BDBM50221062
PNG
(9,10-dimethoxy-5,7-dihydro-4H-pyrrolo[3,2,1-de]phe...)
Show SMILES COc1cc2CN3CCc4cccc(c34)-c2cc1OC
Show InChI InChI=1S/C17H17NO2/c1-19-15-8-12-10-18-7-6-11-4-3-5-13(17(11)18)14(12)9-16(15)20-2/h3-5,8-9H,6-7,10H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 3.87E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of AChE by Ellman method

J Nat Prod 70: 1458-61 (2007)


Article DOI: 10.1021/np0702077
BindingDB Entry DOI: 10.7270/Q2MK6DQQ
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))		BDBM50221072
PNG
(CHEMBL251076 | Epinorgalantamine)
Show SMILES COc1ccc2CN(C)C[C@@H](O)[C@@]34C=C[C@@H](O)C[C@@H]3Oc1c24 |c:13|
Show InChI InChI=1S/C17H21NO4/c1-18-8-10-3-4-12(21-2)16-15(10)17(13(20)9-18)6-5-11(19)7-14(17)22-16/h3-6,11,13-14,19-20H,7-9H2,1-2H3/t11-,13-,14+,17+/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 9.01E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of AChE by Ellman method

J Nat Prod 70: 1458-61 (2007)


Article DOI: 10.1021/np0702077
BindingDB Entry DOI: 10.7270/Q2MK6DQQ
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))		BDBM50221067
PNG
(10-O-methylhostasine | CHEMBL250688)
Show SMILES COc1cc2c(C(=O)O[C@@]22[C@@H]3N(C)CCC3=C[C@H](O)[C@H]2O)c(OC)c1OC |c:17|
Show InChI InChI=1S/C19H23NO7/c1-20-6-5-9-7-11(21)17(22)19(16(9)20)10-8-12(24-2)14(25-3)15(26-4)13(10)18(23)27-19/h7-8,11,16-17,21-22H,5-6H2,1-4H3/t11-,16+,17+,19+/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.13E+5n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of AChE by Ellman method

J Nat Prod 70: 1458-61 (2007)


Article DOI: 10.1021/np0702077
BindingDB Entry DOI: 10.7270/Q2MK6DQQ
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))		BDBM50221066
PNG
((-)-lycorine | 9,10-(methylenedioxy)-3,12-didehydr...)
Show SMILES O[C@H]1C=C2CCN3Cc4cc5OCOc5cc4[C@@H]([C@@H]23)[C@@H]1O |r,t:2|
Show InChI InChI=1S/C16H17NO4/c18-11-3-8-1-2-17-6-9-4-12-13(21-7-20-12)5-10(9)14(15(8)17)16(11)19/h3-5,11,14-16,18-19H,1-2,6-7H2/t11-,14-,15+,16+/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
KEGG
PC cid
PC sid
PDB
UniChem

Patents

Similars
Article
PubMed
n/an/a 1.55E+5n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of AChE by Ellman method

J Nat Prod 70: 1458-61 (2007)


Article DOI: 10.1021/np0702077
BindingDB Entry DOI: 10.7270/Q2MK6DQQ
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))		BDBM50221069
PNG
((+)-haemanthamine | CHEMBL401114)
Show SMILES CO[C@H]1C[C@@H]2N3C[C@H](O)[C@@]2(C=C1)c1cc2OCOc2cc1C3 |c:11|
Show InChI InChI=1S/C17H19NO4/c1-20-11-2-3-17-12-6-14-13(21-9-22-14)4-10(12)7-18(8-16(17)19)15(17)5-11/h2-4,6,11,15-16,19H,5,7-9H2,1H3/t11-,15+,16+,17+/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
PDB
UniChem

Similars
Article
PubMed
n/an/a 4.52E+5n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of AChE by Ellman method

J Nat Prod 70: 1458-61 (2007)


Article DOI: 10.1021/np0702077
BindingDB Entry DOI: 10.7270/Q2MK6DQQ
More data for this
Ligand-Target Pair