Compile Data Set for Download or QSAR

Found 28 hits with Last Name = 'flavin' and Initial = 'mt'   

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
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM50002662 ((+)-calanolide A | (+)-calnolide A | (10R,11S,12S)...) Show SMILES CCCc1cc(=O)oc2c3[C@@H](O)[C@H](C)[C@@H](C)Oc3c3C=CC(C)(C)Oc3c12 |r,c:20| Show InChI InChI=1S/C22H26O5/c1-6-7-13-10-15(23)26-21-16(13)20-14(8-9-22(4,5)27-20)19-17(21)18(24)11(2)12(3)25-19/h8-12,18,24H,6-7H2,1-5H3/t11-,12-,18+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	380	n/a	n/a	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibitory activity against DNA -dependent DNA polymerase(DDDP) of HIV-1 RT Nucleic Acid polymerase				J Med Chem 39: 1303-13 (1996) Article DOI: 10.1021/jm950797i BindingDB Entry DOI: 10.7270/Q2WD3ZN2
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM50002662 ((+)-calanolide A | (+)-calnolide A | (10R,11S,12S)...) Show SMILES CCCc1cc(=O)oc2c3[C@@H](O)[C@H](C)[C@@H](C)Oc3c3C=CC(C)(C)Oc3c12 |r,c:20| Show InChI InChI=1S/C22H26O5/c1-6-7-13-10-15(23)26-21-16(13)20-14(8-9-22(4,5)27-20)19-17(21)18(24)11(2)12(3)25-19/h8-12,18,24H,6-7H2,1-5H3/t11-,12-,18+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	380	n/a	n/a	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibitory activity against DNA -dependent DNA polymerase(DDDP) of HIV-1 RT Nucleic Acid polymerase				J Med Chem 39: 1303-13 (1996) Article DOI: 10.1021/jm950797i BindingDB Entry DOI: 10.7270/Q2WD3ZN2
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM50050430 ((10S,12S)-12-Hydroxy-6,6,10,11-tetramethyl-4-propy...) Show SMILES CCCc1cc(=O)oc2c3[C@@H](O)C(C)[C@H](C)Oc3c3C=CC(C)(C)Oc3c12 |c:20| Show InChI InChI=1S/C22H26O5/c1-6-7-13-10-15(23)26-21-16(13)20-14(8-9-22(4,5)27-20)19-17(21)18(24)11(2)12(3)25-19/h8-12,18,24H,6-7H2,1-5H3/t11?,12-,18-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibitory activity against DNA -dependent DNA polymerase(DDDP) of HIV-1 RT Nucleic Acid polymerase				J Med Chem 39: 1303-13 (1996) Article DOI: 10.1021/jm950797i BindingDB Entry DOI: 10.7270/Q2WD3ZN2
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM50050430 ((10S,12S)-12-Hydroxy-6,6,10,11-tetramethyl-4-propy...) Show SMILES CCCc1cc(=O)oc2c3[C@@H](O)C(C)[C@H](C)Oc3c3C=CC(C)(C)Oc3c12 |c:20| Show InChI InChI=1S/C22H26O5/c1-6-7-13-10-15(23)26-21-16(13)20-14(8-9-22(4,5)27-20)19-17(21)18(24)11(2)12(3)25-19/h8-12,18,24H,6-7H2,1-5H3/t11?,12-,18-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	970	n/a	n/a	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibitory activity against RNA-dependent DNA polymerase(RDDP) of HIV-1 RT Nucleic Acid polymerase				J Med Chem 39: 1303-13 (1996) Article DOI: 10.1021/jm950797i BindingDB Entry DOI: 10.7270/Q2WD3ZN2
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5 (RAT)	BDBM50226536 (CHEMBL98190) Show SMILES Cl.CCN(CC)CCC1COC(C1=O)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C22H27NO2.ClH/c1-3-23(4-2)16-15-18-17-25-22(21(18)24,19-11-7-5-8-12-19)20-13-9-6-10-14-20;/h5-14,18H,3-4,15-17H2,1-2H3;1H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity against sigma receptor				J Med Chem 30: 278-85 (1987) BindingDB Entry DOI: 10.7270/Q2GT5QCR
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM50002662 ((+)-calanolide A | (+)-calnolide A | (10R,11S,12S)...) Show SMILES CCCc1cc(=O)oc2c3[C@@H](O)[C@H](C)[C@@H](C)Oc3c3C=CC(C)(C)Oc3c12 |r,c:20| Show InChI InChI=1S/C22H26O5/c1-6-7-13-10-15(23)26-21-16(13)20-14(8-9-22(4,5)27-20)19-17(21)18(24)11(2)12(3)25-19/h8-12,18,24H,6-7H2,1-5H3/t11-,12-,18+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibitory activity against TIBO-resistant HIV-1 RT Nucleic Acid polymerase				J Med Chem 39: 1303-13 (1996) Article DOI: 10.1021/jm950797i BindingDB Entry DOI: 10.7270/Q2WD3ZN2
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50336799 (5,5',5''-[1,3,6-naphthalenetriyltris(sulfonylimino...) Show SMILES Cc1ccc(cc1NC(=O)c1cccc(NC(=O)Nc2cccc(c2)C(=O)Nc2cc(ccc2C)C(=O)Nc2ccc(c3cc(cc(c23)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O)c1)C(=O)Nc1ccc(c2cc(cc(c12)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O Show InChI InChI=1S/C51H40N6O23S6/c1-25-9-11-29(49(60)54-37-13-15-41(83(69,70)71)35-21-33(81(63,64)65)23-43(45(35)37)85(75,76)77)19-39(25)56-47(58)27-5-3-7-31(17-27)52-51(62)53-32-8-4-6-28(18-32)48(59)57-40-20-30(12-10-26(40)2)50(61)55-38-14-16-42(84(72,73)74)36-22-34(82(66,67)68)24-44(46(36)38)86(78,79)80/h3-24H,1-2H3,(H,54,60)(H,55,61)(H,56,58)(H,57,59)(H2,52,53,62)(H,63,64,65)(H,66,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77)(H,78,79,80)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.38E+4	n/a	n/a	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase p66/p51 expressed in Escherichia coli				J Nat Prod 60: 884-8 (1997) Article DOI: 10.1021/np9700275 BindingDB Entry DOI: 10.7270/Q2JD50MP
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM50050430 ((10S,12S)-12-Hydroxy-6,6,10,11-tetramethyl-4-propy...) Show SMILES CCCc1cc(=O)oc2c3[C@@H](O)C(C)[C@H](C)Oc3c3C=CC(C)(C)Oc3c12 |c:20| Show InChI InChI=1S/C22H26O5/c1-6-7-13-10-15(23)26-21-16(13)20-14(8-9-22(4,5)27-20)19-17(21)18(24)11(2)12(3)25-19/h8-12,18,24H,6-7H2,1-5H3/t11?,12-,18-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.76E+4	n/a	n/a	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibitory activity against TIBO-resistant HIV-1 RT Nucleic Acid polymerase				J Med Chem 39: 1303-13 (1996) Article DOI: 10.1021/jm950797i BindingDB Entry DOI: 10.7270/Q2WD3ZN2
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5 (RAT)	BDBM50226537 (CHEMBL319799) Show SMILES Cl.[H][C@]1(CN(CC)CC)C[C@]2([H])COC(c3ccccc3)(c3ccccc3)[C@]2([H])O1 |r| Show InChI InChI=1S/C23H29NO2.ClH/c1-3-24(4-2)16-21-15-18-17-25-23(22(18)26-21,19-11-7-5-8-12-19)20-13-9-6-10-14-20;/h5-14,18,21-22H,3-4,15-17H2,1-2H3;1H/t18-,21-,22-;/m1./s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity for dopamine receptor D2 was evaluated by the ability to displace [3H]spiperone				J Med Chem 30: 278-85 (1987) BindingDB Entry DOI: 10.7270/Q2GT5QCR
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM50050431 ((-)-calanolide B | (10S,11R,12S)-12-Hydroxy-6,6,10...) Show SMILES CCCc1cc(=O)oc2c3[C@@H](O)[C@@H](C)[C@H](C)Oc3c3C=CC(C)(C)Oc3c12 |r,c:20| Show InChI InChI=1S/C22H26O5/c1-6-7-13-10-15(23)26-21-16(13)20-14(8-9-22(4,5)27-20)19-17(21)18(24)11(2)12(3)25-19/h8-12,18,24H,6-7H2,1-5H3/t11-,12-,18-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.78E+4	n/a	n/a	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibitory activity against RNA-dependent DNA polymerase(RDDP) of HIV-1 RT Nucleic Acid polymerase				J Med Chem 39: 1303-13 (1996) Article DOI: 10.1021/jm950797i BindingDB Entry DOI: 10.7270/Q2WD3ZN2
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50323214 (6-[4-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)-phenoxy...) Show SMILES Oc1ccc(cc1)-c1cc(=O)c2c(O)c(Oc3ccc(cc3)-c3cc(O)c4c(cc(O)cc4=O)o3)c(O)cc2o1 Show InChI InChI=1S/C30H18O10/c31-16-5-1-14(2-6-16)24-12-21(35)28-26(40-24)13-22(36)30(29(28)37)38-18-7-3-15(4-8-18)23-11-20(34)27-19(33)9-17(32)10-25(27)39-23/h1-13,31-32,34,36-37H	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase p66/p51 expressed in Escherichia coli				J Nat Prod 60: 884-8 (1997) Article DOI: 10.1021/np9700275 BindingDB Entry DOI: 10.7270/Q2JD50MP
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50323212 (6-[5-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)-2-hydro...) Show SMILES Oc1ccc(cc1)-c1cc(=O)c2c(O)c(c(O)cc2o1)-c1cc(ccc1O)-c1cc(O)c2c(cc(O)cc2=O)o1 |(14.56,-27.41,;13.23,-26.63,;11.89,-27.39,;10.56,-26.61,;10.57,-25.07,;11.9,-24.31,;13.23,-25.08,;9.25,-24.3,;7.91,-25.06,;6.59,-24.28,;5.25,-25.04,;6.6,-22.75,;5.27,-21.99,;3.93,-22.76,;5.28,-20.46,;6.6,-19.69,;6.6,-18.15,;7.93,-20.45,;7.93,-21.99,;9.26,-22.76,;3.95,-19.69,;2.61,-20.46,;1.28,-19.68,;1.28,-18.14,;2.61,-17.37,;3.95,-18.15,;5.29,-17.38,;-.06,-20.44,;-.06,-22,;-1.41,-22.77,;-1.41,-24.31,;-2.75,-21.99,;-2.75,-20.44,;-4.08,-19.67,;-5.41,-20.45,;-6.75,-19.67,;-5.42,-21.99,;-4.08,-22.76,;-4.08,-24.3,;-1.41,-19.66,)| Show InChI InChI=1S/C30H18O10/c31-15-4-1-13(2-5-15)23-11-22(37)29-26(39-23)12-20(35)27(30(29)38)17-7-14(3-6-18(17)33)24-10-21(36)28-19(34)8-16(32)9-25(28)40-24/h1-12,31-33,35-36,38H	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase p66/p51 expressed in Escherichia coli				J Nat Prod 60: 884-8 (1997) Article DOI: 10.1021/np9700275 BindingDB Entry DOI: 10.7270/Q2JD50MP
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50478418 (Agathisflavone | CHEBI:2512) Show SMILES Oc1ccc(cc1)-c1cc(=O)c2c(O)c(c(O)cc2o1)-c1c(O)cc(O)c2c1oc(cc2=O)-c1ccc(O)cc1 |(23.42,3.76,;23.41,2.23,;24.74,1.44,;24.74,-.09,;23.4,-.85,;22.07,-.08,;22.07,1.46,;23.39,-2.38,;24.72,-3.16,;24.71,-4.7,;26.05,-5.48,;23.38,-5.46,;23.38,-7,;24.71,-7.78,;22.04,-7.77,;20.71,-7,;19.38,-7.76,;20.72,-5.46,;22.05,-4.69,;22.05,-3.15,;22.04,-9.31,;20.71,-10.08,;19.38,-9.31,;20.71,-11.62,;22.04,-12.4,;22.04,-13.94,;23.37,-11.63,;23.37,-10.07,;24.71,-9.29,;26.06,-10.08,;26.06,-11.63,;24.71,-12.4,;24.71,-13.94,;27.39,-9.32,;28.73,-10.09,;30.06,-9.33,;30.06,-7.78,;31.4,-7.02,;28.72,-7.01,;27.39,-7.78,)| Show InChI InChI=1S/C30H18O10/c31-15-5-1-13(2-6-15)22-11-20(36)26-24(39-22)12-21(37)27(29(26)38)28-18(34)9-17(33)25-19(35)10-23(40-30(25)28)14-3-7-16(32)8-4-14/h1-12,31-34,37-38H	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase p66/p51 expressed in Escherichia coli				J Nat Prod 60: 884-8 (1997) Article DOI: 10.1021/np9700275 BindingDB Entry DOI: 10.7270/Q2JD50MP
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50478419 ((+)-Morelloflavone | Morelloflavone) Show SMILES Oc1ccc(cc1)[C@H]1Oc2cc(O)cc(O)c2C(=O)[C@@H]1c1c(O)cc(O)c2c1oc(cc2=O)-c1ccc(O)c(O)c1 |r| Show InChI InChI=1S/C30H20O11/c31-14-4-1-12(2-5-14)29-27(28(39)25-18(35)8-15(32)9-23(25)41-29)26-20(37)10-19(36)24-21(38)11-22(40-30(24)26)13-3-6-16(33)17(34)7-13/h1-11,27,29,31-37H/t27-,29+/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.16E+5	n/a	n/a	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase p66/p51 expressed in Escherichia coli				J Nat Prod 60: 884-8 (1997) Article DOI: 10.1021/np9700275 BindingDB Entry DOI: 10.7270/Q2JD50MP
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50129952 (2-(3-(5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-c...) Show SMILES Oc1ccc(cc1)-c1cc(=O)c2c(O)cc(O)c(-c3cc(ccc3O)-c3cc(O)c4c(cc(O)cc4=O)o3)c2o1 |(13.25,-26.01,;14.59,-25.24,;14.59,-23.7,;15.92,-22.93,;17.26,-23.7,;17.26,-25.24,;15.93,-26.01,;18.58,-22.93,;19.91,-23.69,;21.23,-22.92,;22.57,-23.69,;21.22,-21.4,;22.56,-20.64,;23.88,-21.41,;22.55,-19.1,;21.22,-18.33,;21.22,-16.79,;19.9,-19.11,;18.57,-18.34,;17.23,-19.1,;15.9,-18.33,;15.9,-16.79,;17.23,-16.02,;18.57,-16.79,;19.91,-16.02,;14.57,-19.09,;14.56,-20.65,;13.21,-21.42,;13.21,-22.96,;11.87,-20.64,;11.88,-19.08,;10.54,-18.32,;9.21,-19.09,;7.87,-18.32,;9.21,-20.64,;10.54,-21.41,;10.54,-22.95,;13.22,-18.3,;19.9,-20.64,;18.58,-21.4,)| Show InChI InChI=1S/C30H18O10/c31-15-4-1-13(2-5-15)24-12-23(38)29-21(36)10-20(35)27(30(29)40-24)17-7-14(3-6-18(17)33)25-11-22(37)28-19(34)8-16(32)9-26(28)39-25/h1-12,31-33,35-37H	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.19E+5	n/a	n/a	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase p66/p51 expressed in Escherichia coli				J Nat Prod 60: 884-8 (1997) Article DOI: 10.1021/np9700275 BindingDB Entry DOI: 10.7270/Q2JD50MP
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM50050431 ((-)-calanolide B | (10S,11R,12S)-12-Hydroxy-6,6,10...) Show SMILES CCCc1cc(=O)oc2c3[C@@H](O)[C@@H](C)[C@H](C)Oc3c3C=CC(C)(C)Oc3c12 |r,c:20| Show InChI InChI=1S/C22H26O5/c1-6-7-13-10-15(23)26-21-16(13)20-14(8-9-22(4,5)27-20)19-17(21)18(24)11(2)12(3)25-19/h8-12,18,24H,6-7H2,1-5H3/t11-,12-,18-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.56E+5	n/a	n/a	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibitory activity against DNA -dependent DNA polymerase(DDDP) of HIV-1 RT Nucleic Acid polymerase				J Med Chem 39: 1303-13 (1996) Article DOI: 10.1021/jm950797i BindingDB Entry DOI: 10.7270/Q2WD3ZN2
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50478421 (CHEMBL445452) Show SMILES Oc1ccc(cc1)[C@H]1Oc2cc(O)cc(O)c2C(=O)[C@@H]1c1c(O)cc(O)c2C(=O)C[C@H](Oc12)c1ccc(O)c(O)c1 |r| Show InChI InChI=1S/C30H22O11/c31-14-4-1-12(2-5-14)29-27(28(39)25-18(35)8-15(32)9-23(25)41-29)26-20(37)10-19(36)24-21(38)11-22(40-30(24)26)13-3-6-16(33)17(34)7-13/h1-10,22,27,29,31-37H,11H2/t22-,27-,29+/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.70E+5	n/a	n/a	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase p66/p51 expressed in Escherichia coli				J Nat Prod 60: 884-8 (1997) Article DOI: 10.1021/np9700275 BindingDB Entry DOI: 10.7270/Q2JD50MP
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50368352 (Cerubidine | DAUNORUBICIN) Show SMILES COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(C)=O |r| Show InChI InChI=1S/C27H29NO10/c1-10-22(30)14(28)7-17(37-10)38-16-9-27(35,11(2)29)8-13-19(16)26(34)21-20(24(13)32)23(31)12-5-4-6-15(36-3)18(12)25(21)33/h4-6,10,14,16-17,22,30,32,34-35H,7-9,28H2,1-3H3/t10-,14-,16-,17-,22+,27-/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	2.36E+5	n/a	n/a	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase p66/p51 expressed in Escherichia coli				J Nat Prod 60: 884-8 (1997) Article DOI: 10.1021/np9700275 BindingDB Entry DOI: 10.7270/Q2JD50MP
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50478420 (CHEMBL456859) Show SMILES Oc1ccc(cc1)[C@@H]1CC(=O)c2c(O)cc(O)c([C@@H]3[C@H](Oc4cc(O)cc(O)c4C3=O)c3ccc(O)cc3)c2O1 |r| Show InChI InChI=1S/C30H22O10/c31-15-5-1-13(2-6-15)22-12-21(37)24-19(35)11-20(36)26(30(24)39-22)27-28(38)25-18(34)9-17(33)10-23(25)40-29(27)14-3-7-16(32)8-4-14/h1-11,22,27,29,31-36H,12H2/t22-,27-,29+/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.36E+5	n/a	n/a	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase p66/p51 expressed in Escherichia coli				J Nat Prod 60: 884-8 (1997) Article DOI: 10.1021/np9700275 BindingDB Entry DOI: 10.7270/Q2JD50MP
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM7458 (5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one...) Show SMILES Oc1ccc(cc1)-c1cc(=O)c2c(O)cc(O)cc2o1 Show InChI InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	4.43E+5	n/a	n/a	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant reverse transcriptase p66/p51 expressed in Escherichia coli				J Nat Prod 60: 884-8 (1997) Article DOI: 10.1021/np9700275 BindingDB Entry DOI: 10.7270/Q2JD50MP
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50002665 ((10R,11S)-6,6,10,11-Tetramethyl-4-propyl-10,11-dih...) Show SMILES CCCc1cc(=O)oc2c3C(=O)[C@@H](C)[C@@H](C)Oc3c3C=CC(C)(C)Oc3c12 |c:20| Show InChI InChI=1S/C22H24O5/c1-6-7-13-10-15(23)26-21-16(13)20-14(8-9-22(4,5)27-20)19-17(21)18(24)11(2)12(3)25-19/h8-12H,6-7H2,1-5H3/t11-,12+/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibition of HIV-1 reverse transcriptase using a poly(rC):oligo(dG)12-18 template primer				J Med Chem 40: 1005-17 (1997) Article DOI: 10.1021/jm960355m BindingDB Entry DOI: 10.7270/Q2N015NG
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50002662 ((+)-calanolide A | (+)-calnolide A | (10R,11S,12S)...) Show SMILES CCCc1cc(=O)oc2c3[C@@H](O)[C@H](C)[C@@H](C)Oc3c3C=CC(C)(C)Oc3c12 |r,c:20| Show InChI InChI=1S/C22H26O5/c1-6-7-13-10-15(23)26-21-16(13)20-14(8-9-22(4,5)27-20)19-17(21)18(24)11(2)12(3)25-19/h8-12,18,24H,6-7H2,1-5H3/t11-,12-,18+/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	320	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibition of HIV-1 reverse transcriptase using a poly(rC):oligo(dG)12-18 template primer				J Med Chem 40: 1005-17 (1997) Article DOI: 10.1021/jm960355m BindingDB Entry DOI: 10.7270/Q2N015NG
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50057014 ((10R,12R)-12-Hydroxy-6,6,10,11,11-pentamethyl-4-pr...) Show SMILES CCCc1cc(=O)oc2c3[C@H](O)C(C)(C)[C@@H](C)Oc3c3C=CC(C)(C)Oc3c12 |c:21| Show InChI InChI=1S/C23H28O5/c1-7-8-13-11-15(24)27-20-16(13)19-14(9-10-22(3,4)28-19)18-17(20)21(25)23(5,6)12(2)26-18/h9-12,21,25H,7-8H2,1-6H3/t12-,21+/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3.20E+4	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibition of HIV-1 reverse transcriptase using a poly(rC):oligo(dG)12-18 template primer				J Med Chem 40: 1005-17 (1997) Article DOI: 10.1021/jm960355m BindingDB Entry DOI: 10.7270/Q2N015NG
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50054452 ((10R,11R)-6,6,10,11-Tetramethyl-4-propyl-10,11-dih...) Show SMILES CCCc1cc(=O)oc2c3C(=O)[C@H](C)[C@@H](C)Oc3c3C=CC(C)(C)Oc3c12 |c:20| Show InChI InChI=1S/C22H24O5/c1-6-7-13-10-15(23)26-21-16(13)20-14(8-9-22(4,5)27-20)19-17(21)18(24)11(2)12(3)25-19/h8-12H,6-7H2,1-5H3/t11-,12-/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	4.00E+4	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibition of HIV-1 reverse transcriptase using a poly(rC):oligo(dG)12-18 template primer				J Med Chem 40: 1005-17 (1997) Article DOI: 10.1021/jm960355m BindingDB Entry DOI: 10.7270/Q2N015NG
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50057028 ((11S,12S)-12-Hydroxy-6,6,11-trimethyl-4-propyl-11,...) Show SMILES CCCc1cc(=O)oc2c3[C@@H](O)[C@@H](C)COc3c3C=CC(C)(C)Oc3c12 |c:19| Show InChI InChI=1S/C21H24O5/c1-5-6-12-9-14(22)25-20-15(12)19-13(7-8-21(3,4)26-19)18-16(20)17(23)11(2)10-24-18/h7-9,11,17,23H,5-6,10H2,1-4H3/t11-,17-/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibition of HIV-1 reverse transcriptase using a poly(rC):oligo(dG)12-18 template primer				J Med Chem 40: 1005-17 (1997) Article DOI: 10.1021/jm960355m BindingDB Entry DOI: 10.7270/Q2N015NG
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50057037 ((11R,12R)-12-Hydroxy-6,6,10,10,11-pentamethyl-4-pr...) Show SMILES CCCc1cc(=O)oc2c3[C@H](O)[C@@H](C)C(C)(C)Oc3c3C=CC(C)(C)Oc3c12 |c:21| Show InChI InChI=1S/C23H28O5/c1-7-8-13-11-15(24)26-21-16(13)19-14(9-10-22(3,4)27-19)20-17(21)18(25)12(2)23(5,6)28-20/h9-12,18,25H,7-8H2,1-6H3/t12-,18-/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibition of HIV-1 reverse transcriptase using a poly(rC):oligo(dG)12-18 template primer				J Med Chem 40: 1005-17 (1997) Article DOI: 10.1021/jm960355m BindingDB Entry DOI: 10.7270/Q2N015NG
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50057029 ((10R,11S,12S)-10-Ethyl-12-hydroxy-6,6,11-trimethyl...) Show SMILES CCCc1cc(=O)oc2c3[C@@H](O)[C@H](C)[C@@H](CC)Oc3c3C=CC(C)(C)Oc3c12 |c:21| Show InChI InChI=1S/C23H28O5/c1-6-8-13-11-16(24)27-22-17(13)21-14(9-10-23(4,5)28-21)20-18(22)19(25)12(3)15(7-2)26-20/h9-12,15,19,25H,6-8H2,1-5H3/t12-,15-,19+/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibition of HIV-1 reverse transcriptase using a poly(rC):oligo(dG)12-18 template primer				J Med Chem 40: 1005-17 (1997) Article DOI: 10.1021/jm960355m BindingDB Entry DOI: 10.7270/Q2N015NG
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus 1)	BDBM50057030 ((10R,11S,12R)-10-Ethyl-12-hydroxy-6,6,11-trimethyl...) Show SMILES CCCc1cc(=O)oc2c3[C@H](O)[C@H](C)[C@@H](CC)Oc3c3C=CC(C)(C)Oc3c12 |c:21| Show InChI InChI=1S/C23H28O5/c1-6-8-13-11-16(24)27-22-17(13)21-14(9-10-23(4,5)28-21)20-18(22)19(25)12(3)15(7-2)26-20/h9-12,15,19,25H,6-8H2,1-5H3/t12-,15-,19-/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibition of HIV-1 reverse transcriptase using a poly(rC):oligo(dG)12-18 template primer				J Med Chem 40: 1005-17 (1997) Article DOI: 10.1021/jm960355m BindingDB Entry DOI: 10.7270/Q2N015NG
					More data for this Ligand-Target Pair