Found 26 hits Enz. Inhib. hit(s) with all data for entry = 5537 Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86902
(1-((5-bromopyridin-3-yloxy)methyl)-N-methylcyclopr...)Show InChI InChI=1S/C10H13BrN2O/c1-12-10(2-3-10)7-14-9-4-8(11)5-13-6-9/h4-6,12H,2-3,7H2,1H3 | PDB
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Similars
| Article PubMed
| 1.07 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86919
(CAS_22325164 | N-methyl-1-((pyridin-3-yloxy)methyl...)Show InChI InChI=1S/C10H14N2O/c1-11-10(4-5-10)8-13-9-3-2-6-12-7-9/h2-3,6-7,11H,4-5,8H2,1H3 | PDB
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| 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM50004108
((+-)-nicotine | (R,S)-nicotine | (RS)-nicotine | 3...)Show InChI InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3 | PDB
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| PDB Article PubMed
| 4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86899
(1-((5-bromo-6-chloropyridin-3-yloxy)methyl)-N-meth...)Show InChI InChI=1S/C10H12BrClN2O/c1-13-10(2-3-10)6-15-7-4-8(11)9(12)14-5-7/h4-5,13H,2-3,6H2,1H3 | PDB
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| 5.37 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86907
(1-((5-ethynylpyridin-3-yloxy)methyl)-N-methylcyclo...)Show InChI InChI=1S/C12H14N2O/c1-3-10-6-11(8-14-7-10)15-9-12(13-2)4-5-12/h1,6-8,13H,4-5,9H2,2H3 | PDB
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| Article PubMed
| 6.56 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86918
(1-((6-chloropyridin-3-yloxy)methyl)-N-methylcyclop...)Show InChI InChI=1S/C10H13ClN2O/c1-12-10(4-5-10)7-14-8-2-3-9(11)13-6-8/h2-3,6,12H,4-5,7H2,1H3 | PDB
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| 13 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86911
(1-(pyridin-3-yloxymethyl)-cyclopropylamine; hydroc...)Show InChI InChI=1S/C9H12N2O/c10-9(3-4-9)7-12-8-2-1-5-11-6-8/h1-2,5-6H,3-4,7,10H2 | PDB
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| Article PubMed
| 34 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86915
(1-((6-bromopyridin-3-yloxy)methyl)-N-methylcyclopr...)Show InChI InChI=1S/C10H13BrN2O/c1-12-10(4-5-10)7-14-8-2-3-9(11)13-6-8/h2-3,6,12H,4-5,7H2,1H3 | PDB
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| Article PubMed
| 38.8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM10759
(2-acetoxyethyl(trimethyl)ammonium;bromide | 2-acet...)Show InChI InChI=1S/C7H16NO2/c1-7(9)10-6-5-8(2,3)4/h5-6H2,1-4H3/q+1 | PDB
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| Article PubMed
| 39 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86922
(CAS_9899400 | N-methyl-1-((6-methylpyridin-3-yloxy...)Show InChI InChI=1S/C11H16N2O/c1-9-3-4-10(7-13-9)14-8-11(12-2)5-6-11/h3-4,7,12H,5-6,8H2,1-2H3 | PDB
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| 40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86905
(CAS_45263892 | N-methyl-1-((5-vinylpyridin-3-yloxy...)Show InChI InChI=1S/C12H16N2O/c1-3-10-6-11(8-14-7-10)15-9-12(13-2)4-5-12/h3,6-8,13H,1,4-5,9H2,2H3 | PDB
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| Article PubMed
| 70.1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86916
(CAS_22325080 | NSC_22325080 | dimethyl-[1-(pyridin...)Show InChI InChI=1S/C11H16N2O/c1-13(2)11(5-6-11)9-14-10-4-3-7-12-8-10/h3-4,7-8H,5-6,9H2,1-2H3 | PDB
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| PC cid PC sid UniChem
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| Article PubMed
| 95 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86908
(1-(6-chloro-pyridin-3-yloxymethyl)-cyclopropylamin...)Show InChI InChI=1S/C9H11ClN2O/c10-8-2-1-7(5-12-8)13-6-9(11)3-4-9/h1-2,5H,3-4,6,11H2 | PDB
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| 98 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86920
(CAS_9944441 | NSC_9944441 | methyl-{1-[2-(pyridin-...)Show InChI InChI=1S/C11H16N2O/c1-12-11(4-5-11)6-8-14-10-3-2-7-13-9-10/h2-3,7,9,12H,4-6,8H2,1H3 | PDB
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| PC cid PC sid UniChem
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| Article PubMed
| 109 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86912
(CAS_45263898 | N-methyl-1-(2-(pyridin-3-yl)ethyl)c...)Show InChI InChI=1S/C11H16N2/c1-12-11(6-7-11)5-4-10-3-2-8-13-9-10/h2-3,8-9,12H,4-7H2,1H3 | PDB
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| PC cid PC sid UniChem
| Article PubMed
| 251 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86921
(1-((6-methylpyridin-3-yloxy)methyl)cyclopropanamin...)Show InChI InChI=1S/C10H14N2O/c1-8-2-3-9(6-12-8)13-7-10(11)4-5-10/h2-3,6H,4-5,7,11H2,1H3 | PDB
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| 266 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86914
(CAS_45263712 | NSC_45263712 | [1-(5-bromo-pyridin-...)Show InChI InChI=1S/C11H15BrN2O/c1-14(2)11(3-4-11)8-15-10-5-9(12)6-13-7-10/h5-7H,3-4,8H2,1-2H3 | PDB
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| Article PubMed
| 273 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86900
(1-((6-chloropyridin-3-yloxy)methyl)-N,N-dimethylcy...)Show InChI InChI=1S/C11H15ClN2O/c1-14(2)11(5-6-11)8-15-9-3-4-10(12)13-7-9/h3-4,7H,5-6,8H2,1-2H3 | PDB
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| Article PubMed
| 304 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86901
(1-((6-bromopyridin-3-yloxy)methyl)-N,N-dimethylcyc...)Show InChI InChI=1S/C11H15BrN2O/c1-14(2)11(5-6-11)8-15-9-3-4-10(12)13-7-9/h3-4,7H,5-6,8H2,1-2H3 | PDB
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| Article PubMed
| 394 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86910
(CAS_44454126 | N-ethyl-1-((pyridin-3-yloxy)methyl)...)Show InChI InChI=1S/C11H16N2O/c1-2-13-11(5-6-11)9-14-10-4-3-7-12-8-10/h3-4,7-8,13H,2,5-6,9H2,1H3 | PDB
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| 1.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86909
(CAS_45263866 | N,N-dimethyl-1-((6-methylpyridin-3-...)Show InChI InChI=1S/C12H18N2O/c1-10-4-5-11(8-13-10)15-9-12(6-7-12)14(2)3/h4-5,8H,6-7,9H2,1-3H3 | PDB
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| 1.09E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86903
(CAS_45263725 | CAS_45263737 | NSC_45263725 | NSC_4...)Show InChI InChI=1S/C12H16N2O/c1-13-12(6-7-12)5-3-9-15-11-4-2-8-14-10-11/h2-5,8,10,13H,6-7,9H2,1H3 | PDB
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| 1.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86906
(CAS_9922040 | NSC_9922040 | methyl-[1-(2-pyridin-3...)Show InChI InChI=1S/C11H14N2/c1-12-11(6-7-11)5-4-10-3-2-8-13-9-10/h2-5,8-9,12H,6-7H2,1H3 | PDB
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| 1.16E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86913
(3-((1-(pyrrolidin-1-yl)cyclopropyl)methoxy)pyridin...)Show InChI InChI=1S/C13H18N2O/c1-2-9-15(8-1)13(5-6-13)11-16-12-4-3-7-14-10-12/h3-4,7,10H,1-2,5-6,8-9,11H2 | PDB
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| Article PubMed
| 1.61E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86903
(CAS_45263725 | CAS_45263737 | NSC_45263725 | NSC_4...)Show InChI InChI=1S/C12H16N2O/c1-13-12(6-7-12)5-3-9-15-11-4-2-8-14-10-11/h2-5,8,10,13H,6-7,9H2,1H3 | PDB
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| PC cid PC sid UniChem
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| Article PubMed
| 2.28E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |
Neuronal acetylcholine receptor subunit alpha-4
(Rattus norvegicus (Rat)) | BDBM86917
(CAS_44454204 | NSC_44454204 | methyl-{1-[3-(pyridi...)Show InChI InChI=1S/C12H18N2O/c1-13-12(6-7-12)5-3-9-15-11-4-2-8-14-10-11/h2,4,8,10,13H,3,5-7,9H2,1H3 | PDB
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| PC cid PC sid UniChem
Similars
| Article PubMed
| 2.46E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SERVIER, Chemistry Research Division A
Curated by PDSP Ki Database
| |
Bioorg Med Chem Lett 18: 2188-93 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.075 BindingDB Entry DOI: 10.7270/Q2QF8RG1 |
More data for this Ligand-Target Pair | |