Compile Data Set for Download or QSAR
Found 46 with Last Name = 'arote' and Initial = 'r'
TargetAcetylcholinesterase(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50513912(CHEMBL4524569)copy SMILEScopy InChI
Affinity DataKi:  61nMAssay Description:Inhibition of Acetylcholinesterase (unknown origin) using acetylthiocholine iodide as substrate by Ellman's spectrophotometric methodMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50513900(CHEMBL4444582)copy SMILEScopy InChI
Affinity DataKi:  61nMAssay Description:Inhibition of Acetylcholinesterase (unknown origin) using acetylthiocholine iodide as substrate by Ellman's spectrophotometric methodMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50513907(CHEMBL4579543)copy SMILEScopy InChI
Affinity DataKi:  61nMAssay Description:Inhibition of Acetylcholinesterase (unknown origin) using acetylthiocholine iodide as substrate by Ellman's spectrophotometric methodMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50513908(CHEMBL4453373)copy SMILEScopy InChI
Affinity DataKi:  61nMAssay Description:Inhibition of Acetylcholinesterase (unknown origin) using acetylthiocholine iodide as substrate by Ellman's spectrophotometric methodMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50513909(CHEMBL4541764)copy SMILEScopy InChI
Affinity DataKi:  61nMAssay Description:Inhibition of Acetylcholinesterase (unknown origin) using acetylthiocholine iodide as substrate by Ellman's spectrophotometric methodMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetPoly [ADP-ribose] polymerase 1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50513904(CHEMBL4546114)copy SMILEScopy InChI
Affinity DataIC50: 0.5nMAssay Description:Inhibition of human PARP1 expressed in Escherichia coli incubated for 15 to 40 mins by ELISAMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetPoly [ADP-ribose] polymerase 1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50513902(CHEMBL4442022)copy SMILEScopy InChI
Affinity DataIC50: 1.70nMAssay Description:Inhibition of human PARP1 expressed in Escherichia coli incubated for 15 to 40 mins by ELISAMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetPoly [ADP-ribose] polymerase 1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50513901(CHEMBL4579526)copy SMILEScopy InChI
Affinity DataIC50: 2nMAssay Description:Inhibition of human PARP1 expressed in Escherichia coli using histone as substrate by ELISAMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetAldo-keto reductase family 1 member B1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM16452((4-oxo-3-{[5-(trifluoromethyl)-1,3-benzothiazol-2-...)copy SMILEScopy InChI
Affinity DataIC50: 2.10nMAssay Description:Inhibition of human placenta Aldose reductaseMore data for this Ligand-Target Pair
TargetAldo-keto reductase family 1 member B1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50006469(CHEMBL69956 | [8-Oxo-7-(5-trifluoromethyl-benzothi...)copy SMILEScopy InChI
Affinity DataIC50: 2.10nMAssay Description:Inhibition of human Aldose reductaseMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetPoly [ADP-ribose] polymerase 2(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50268124(CHEMBL4078014)copy SMILEScopy InChI
Affinity DataIC50: 2.5nMAssay Description:Inhibition of PARP2 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetPoly [ADP-ribose] polymerase 2(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM27566(4-({3-[(4-cyclopropanecarbonylpiperazin-1-yl)carbo...)copy SMILEScopy InChI
Affinity DataIC50: 2.80nMAssay Description:Inhibition of PARP2 (unknown origin)More data for this Ligand-Target Pair
TargetAldo-keto reductase family 1 member B1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50009781(CHEMBL20169 | [3-(5-Bromo-benzothiazol-2-ylmethyl)...)copy SMILEScopy InChI
Affinity DataIC50: 3.10nMAssay Description:Inhibition of human placenta Aldose reductaseMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetAldo-keto reductase family 1 member B1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50006481(CHEMBL73560 | [1-(5,7-Difluoro-benzothiazol-2-ylme...)copy SMILEScopy InChI
Affinity DataIC50: 3.20nMAssay Description:Inhibition of human Aldose reductaseMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetAldo-keto reductase family 1 member B1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50008471(CHEMBL143234 | [3-(5,7-Difluoro-benzooxazol-2-ylme...)copy SMILEScopy InChI
Affinity DataIC50: 3.20nMAssay Description:Inhibition of human placenta Aldose reductaseMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetPoly [ADP-ribose] polymerase 1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM27566(4-({3-[(4-cyclopropanecarbonylpiperazin-1-yl)carbo...)copy SMILEScopy InChI
Affinity DataIC50: 3.60nMAssay Description:Inhibition of PARP1 (unknown origin) by colorimetric assayMore data for this Ligand-Target Pair
TargetPoly [ADP-ribose] polymerase tankyrase-1(Homo sapiens (Human))TBA
LigandPNGBDBM50612120(CHEMBL5275705)copy SMILES
Ligand InfoPC cidPC sidPDB
In DepthDetails
TargetPoly [ADP-ribose] polymerase tankyrase-1(Homo sapiens (Human))TBA
LigandPNGBDBM50468271(CHEMBL4290134)copy SMILEScopy InChI
In DepthDetails
TargetAldo-keto reductase family 1 member B1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50006471(CHEMBL68580 | [4-Oxo-3-(5-trifluoromethyl-benzothi...)copy SMILEScopy InChI
Affinity DataIC50: 5.20nMAssay Description:Inhibition of human Aldose reductaseMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetPoly [ADP-ribose] polymerase 1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50268134(CHEMBL4097093)copy SMILEScopy InChI
Affinity DataIC50: 6.20nMAssay Description:Inhibition of PARP1 (unknown origin) by colorimetric assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetPoly [ADP-ribose] polymerase tankyrase-1(Homo sapiens (Human))TBA
LigandPNGBDBM50505333(CHEMBL4437173)copy SMILEScopy InChI
TargetPoly [ADP-ribose] polymerase 1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50513903(CHEMBL4547590)copy SMILEScopy InChI
Affinity DataIC50: 8.40nMAssay Description:Inhibition of human PARP1 expressed in Escherichia coli incubated for 10 mins by colorimetric assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetPoly [ADP-ribose] polymerase 1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM27566(4-({3-[(4-cyclopropanecarbonylpiperazin-1-yl)carbo...)copy SMILEScopy InChI
Affinity DataIC50: 8.40nMAssay Description:Inhibition of human PARP1 expressed in Escherichia coli incubated for 10 mins by colorimetric assayMore data for this Ligand-Target Pair
TargetPoly [ADP-ribose] polymerase tankyrase-1(Homo sapiens (Human))TBA
LigandPNGBDBM50019166(CHEMBL336718)copy SMILEScopy InChI
In DepthDetails
TargetPoly [ADP-ribose] polymerase tankyrase-2(Homo sapiens (Human))TBA
LigandPNGBDBM50505333(CHEMBL4437173)copy SMILEScopy InChI
Affinity DataIC50: 9.20nMMore data for this Ligand-Target Pair
TargetPoly [ADP-ribose] polymerase tankyrase-1(Homo sapiens (Human))TBA
LigandPNGBDBM50188337(CHEMBL2058057)copy SMILEScopy InChI
Affinity DataIC50: 11nMMore data for this Ligand-Target Pair
In DepthDetails
TargetPoly [ADP-ribose] polymerase tankyrase-2(Homo sapiens (Human))TBA
LigandPNGBDBM50511566(CHEMBL4448872)copy SMILEScopy InChI
Affinity DataIC50: 11nMMore data for this Ligand-Target Pair
TargetPoly [ADP-ribose] polymerase tankyrase-1(Homo sapiens (Human))TBA
LigandPNGBDBM50612121(CHEMBL5277753)copy SMILES
Affinity DataIC50: 12nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails
TargetPoly [ADP-ribose] polymerase tankyrase-1(Homo sapiens (Human))TBA
LigandPNGBDBM50511566(CHEMBL4448872)copy SMILEScopy InChI
Affinity DataIC50: 14nMMore data for this Ligand-Target Pair
TargetPoly [ADP-ribose] polymerase tankyrase-1(Homo sapiens (Human))TBA
LigandPNGBDBM50612117(CHEMBL5270676)copy SMILES
Affinity DataIC50: 15nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails
TargetAldo-keto reductase family 1 member B1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50006463((3-Benzothiazol-2-ylmethyl-4-oxo-3,4-dihydro-phtha...)copy SMILEScopy InChI
Affinity DataIC50: 19nMAssay Description:Inhibition of human placenta Aldose reductaseMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetAldo-keto reductase family 1 member B1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50513914(CHEMBL4436968)copy SMILEScopy InChI
Affinity DataIC50: 20nMAssay Description:Inhibition of human Aldose reductaseMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetPoly [ADP-ribose] polymerase tankyrase-1(Homo sapiens (Human))TBA
LigandPNGBDBM50612118(CHEMBL3431396)copy SMILES
Affinity DataIC50: 21nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails
TargetPoly [ADP-ribose] polymerase tankyrase-1(Homo sapiens (Human))TBA
LigandPNGBDBM50612119(CHEMBL5267866)copy SMILES
Affinity DataIC50: 23nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails
TargetAldo-keto reductase family 1 member B1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50513913(CHEMBL4458061)copy SMILEScopy InChI
Affinity DataIC50: 46nMAssay Description:Inhibition of human Aldose reductaseMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetProstaglandin E synthase(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50028859(CHEMBL3342698)copy SMILEScopy InChI
Affinity DataIC50: 50nMAssay Description:Inhibition of mPGES-1 in human A549 cells assessed as reduction in IL-beta induced PGE2 release preincubated for 30 mins followed by IL-beta addition...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetPoly [ADP-ribose] polymerase 1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50513910(CHEMBL4450818)copy SMILEScopy InChI
Affinity DataIC50: 97nMAssay Description:Inhibition of N-terminal GST-tagged human PARP1 expressed in a Baculovirus infected Sf9 insect cells using biotinylated substrate incubated for 1 hr ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetVascular endothelial growth factor receptor 2(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM4851((4-chlorophenyl)-[4-(4-pyridylmethyl)phthalazin-1-...)copy SMILEScopy InChI
Affinity DataIC50: 100nMAssay Description:Inhibition of VEGFR2 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetVascular endothelial growth factor receptor 1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM4851((4-chlorophenyl)-[4-(4-pyridylmethyl)phthalazin-1-...)copy SMILEScopy InChI
Affinity DataIC50: 100nMAssay Description:Inhibition of VEGFR1 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetPoly [ADP-ribose] polymerase 1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM27566(4-({3-[(4-cyclopropanecarbonylpiperazin-1-yl)carbo...)copy SMILEScopy InChI
Affinity DataIC50: 139nMAssay Description:Inhibition of N-terminal GST-tagged human PARP1 expressed in a Baculovirus infected Sf9 insect cells using biotinylated substrate incubated for 1 hr ...More data for this Ligand-Target Pair
TargetAurora kinase A(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50513905(CHEMBL4475847)copy SMILEScopy InChI
Affinity DataIC50: 420nMAssay Description:Inhibition of C-terminal His4-tagged Aurora A (unknown origin) using PKB-GSK2 biotinylated peptide as substrate incubated for 90 mins by ELISAMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM8961(1,2,3,4-tetrahydro-9-acridinamine | 1,2,3,4-tetrah...)copy SMILEScopy InChI
Affinity DataIC50: 426nMAssay Description:Inhibition of Acetylcholinesterase (unknown origin) using acetylthiocholine iodide as substrate by Ellman's spectrophotometric methodMore data for this Ligand-Target Pair
TargetPoly [ADP-ribose] polymerase 1(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50513911(CHEMBL4580842)copy SMILEScopy InChI
Affinity DataIC50: 5.00E+3nMAssay Description:Inhibition of human PARP1 expressed in Escherichia coli incubated for 15 to 40 mins by ELISAMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetCytochrome c oxidase subunit 1(Ovis aries)
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50513906(CHEMBL4549769)copy SMILEScopy InChI
Affinity DataIC50: 6.00E+3nMAssay Description:Inhibition of ovine COX1 preincubated for 5 mins followed by arachidonic acid addition and measured after 2 mins by colorimetric methodMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetCytochrome c oxidase subunit 1(Ovis aries)
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM11639(4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyraz...)copy SMILEScopy InChI
Affinity DataIC50: 6.50E+3nMAssay Description:Inhibition of ovine COX1 preincubated for 5 mins followed by arachidonic acid addition and measured after 2 mins by colorimetric methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed
TargetCystic fibrosis transmembrane conductance regulator(Homo sapiens (Human))
Y. B. Chavan College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM160509(US10280160, Example 1. | US9682969, 1)copy SMILEScopy InChI
Affinity DataEC50: <1.00E+4nMAssay Description:Inhibition of human CFTR F508 deletion mutant expressed in rat FRT cells coexpressing YFP-H148Q/I152L 25,22 incubated for 60 to 120 mins in presence ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28W3HMGPubMed