Found 215 hits Enz. Inhib. hit(s) with all data for entry = 50030212 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 |
|---|
Tyrosine-protein kinase transforming protein Fps
(Fujinami sarcoma virus) | BDBM15236
(3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-chr...)Show SMILES Oc1cc(O)c2c(c1)oc(-c1cc(O)c(O)c(O)c1)c(O)c2=O Show InChI InChI=1S/C15H10O8/c16-6-3-7(17)11-10(4-6)23-15(14(22)13(11)21)5-1-8(18)12(20)9(19)2-5/h1-4,16-20,22H | UniProtKB/SwissProt
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| 1.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of Fujinami sarcoma virus pp130fps |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Insulin receptor
(Homo sapiens (Human)) | BDBM15236
(3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-chr...)Show SMILES Oc1cc(O)c2c(c1)oc(-c1cc(O)c(O)c(O)c1)c(O)c2=O Show InChI InChI=1S/C15H10O8/c16-6-3-7(17)11-10(4-6)23-15(14(22)13(11)21)5-1-8(18)12(20)9(19)2-5/h1-4,16-20,22H | PDB
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| 2.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of insulin receptor |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50292509
((8S,11S,14S,17S,20S,23S)-23-((S)-2-((S)-2-((S)-2-a...)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c(F)c(F)c(O)c(F)c1F)C(=O)NCC(O)=O |r| Show InChI InChI=1S/C57H85F4N17O23/c1-23(2)20-33(78-50(96)27(7-5-19-68-57(65)66)71-47(93)26(62)6-4-18-67-56(63)64)55(101)76-32(12-17-39(87)88)54(100)75-31(11-16-38(85)86)53(99)74-30(10-15-37(83)84)52(98)73-29(9-14-36(81)82)51(97)72-28(8-13-35(79)80)49(95)70-24(3)46(92)77-34(48(94)69-22-40(89)90)21-25-41(58)43(60)45(91)44(61)42(25)59/h23-24,26-34,91H,4-22,62H2,1-3H3,(H,69,94)(H,70,95)(H,71,93)(H,72,97)(H,73,98)(H,74,99)(H,75,100)(H,76,101)(H,77,92)(H,78,96)(H,79,80)(H,81,82)(H,83,84)(H,85,86)(H,87,88)(H,89,90)(H4,63,64,67)(H4,65,66,68)/t24-,26-,27-,28-,29-,30-,31-,32-,33-,34?/m0/s1 | PDB
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| 2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50292509
((8S,11S,14S,17S,20S,23S)-23-((S)-2-((S)-2-((S)-2-a...)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c(F)c(F)c(O)c(F)c1F)C(=O)NCC(O)=O |r| Show InChI InChI=1S/C57H85F4N17O23/c1-23(2)20-33(78-50(96)27(7-5-19-68-57(65)66)71-47(93)26(62)6-4-18-67-56(63)64)55(101)76-32(12-17-39(87)88)54(100)75-31(11-16-38(85)86)53(99)74-30(10-15-37(83)84)52(98)73-29(9-14-36(81)82)51(97)72-28(8-13-35(79)80)49(95)70-24(3)46(92)77-34(48(94)69-22-40(89)90)21-25-41(58)43(60)45(91)44(61)42(25)59/h23-24,26-34,91H,4-22,62H2,1-3H3,(H,69,94)(H,70,95)(H,71,93)(H,72,97)(H,73,98)(H,74,99)(H,75,100)(H,76,101)(H,77,92)(H,78,96)(H,79,80)(H,81,82)(H,83,84)(H,85,86)(H,87,88)(H,89,90)(H4,63,64,67)(H4,65,66,68)/t24-,26-,27-,28-,29-,30-,31-,32-,33-,34?/m0/s1 | PDB
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| 2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50048128
(Asp-Arg-Val-Tyr-Val-His-Pro-Phe (Angiotensin II) |...)Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,wU:18.18,3.3,46.46,63.65,wD:7.14,27.26,39.39,59.62,(35.46,.19,;34.15,-.62,;32.79,.12,;34.19,-2.16,;32.87,-2.96,;31.52,-2.23,;31.48,-.69,;30.21,-3.03,;30.25,-4.57,;31.6,-5.31,;31.64,-6.85,;33,-7.58,;33.04,-9.12,;31.73,-9.93,;34.39,-9.85,;28.85,-2.3,;27.54,-3.1,;27.58,-4.64,;26.19,-2.37,;24.87,-3.17,;26.15,-.84,;27.46,-.03,;28.81,-.76,;27.42,1.51,;35.54,-2.89,;35.58,-4.43,;36.86,-2.08,;38.21,-2.82,;38.25,-4.36,;39.6,-5.1,;40.9,-4.3,;42.26,-5.02,;42.3,-6.56,;43.66,-7.3,;40.99,-7.36,;39.64,-6.64,;39.52,-2.02,;39.48,-.47,;40.88,-2.75,;42.19,-1.94,;43.54,-2.68,;44.85,-1.88,;43.58,-4.21,;42.14,-.41,;40.79,.33,;43.46,.4,;43.42,1.94,;42.06,2.68,;42.02,4.22,;40.76,5.08,;41.19,6.56,;42.73,6.61,;43.25,5.16,;44.73,2.75,;44.69,4.29,;46.08,2.01,;46.29,.48,;47.8,.21,;48.53,1.56,;47.47,2.67,;47.75,4.19,;46.59,5.19,;49.23,4.63,;49.59,6.13,;48.47,7.18,;48.83,8.69,;50.3,9.14,;50.67,10.63,;49.55,11.68,;48.07,11.26,;47.71,9.75,;51.07,6.57,;51.42,8.07,;52.19,5.51,)| Show InChI InChI=1S/C49H69N13O12/c1-26(2)39(60-42(67)33(12-8-18-54-49(51)52)56-41(66)32(50)23-38(64)65)45(70)57-34(20-29-14-16-31(63)17-15-29)43(68)61-40(27(3)4)46(71)58-35(22-30-24-53-25-55-30)47(72)62-19-9-13-37(62)44(69)59-36(48(73)74)21-28-10-6-5-7-11-28/h5-7,10-11,14-17,24-27,32-37,39-40,63H,8-9,12-13,18-23,50H2,1-4H3,(H,53,55)(H,56,66)(H,57,70)(H,58,71)(H,59,69)(H,60,67)(H,61,68)(H,64,65)(H,73,74)(H4,51,52,54)/t32-,33-,34-,35-,36-,37-,39-,40-/m0/s1 | PDB
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| 7.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of p60 src |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50038202
(5-((2,5-dihydroxybenzyl)(2-hydroxybenzyl)amino)-2-...)Show SMILES OC(=O)c1cc(ccc1O)N(Cc1ccccc1O)Cc1cc(O)ccc1O Show InChI InChI=1S/C21H19NO6/c23-16-6-8-19(25)14(9-16)12-22(11-13-3-1-2-4-18(13)24)15-5-7-20(26)17(10-15)21(27)28/h1-10,23-26H,11-12H2,(H,27,28) | PDB
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| n/a | n/a | 10.5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50025605
(CHEMBL483830)Show SMILES OC(=O)c1cc(ccc1O)N(Cc1cc(O)ccc1O)Cc1cc(O)ccc1O Show InChI InChI=1S/C21H19NO7/c23-15-2-5-18(25)12(7-15)10-22(11-13-8-16(24)3-6-19(13)26)14-1-4-20(27)17(9-14)21(28)29/h1-9,23-27H,10-11H2,(H,28,29) | PDB
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| n/a | n/a | 25.2 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50007064
(2-Hydroxy-4-[4-(2-nitro-vinyl)-phenoxysulfonyl]-be...)Show SMILES OC(=O)c1ccc(cc1O)[S+]([O-])(=O)Oc1ccc(\C=C\[N+]([O-])=O)cc1 Show InChI InChI=1S/C15H11NO8S/c17-14-9-12(5-6-13(14)15(18)19)25(22,23)24-11-3-1-10(2-4-11)7-8-16(20)21/h1-9H,(H2-,17,18,19,22,23)/b8-7+ | PDB
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| n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM18137
(AMP | CHEMBL752 | US11185100, TABLE 7.3 | [(2R,3S,...)Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]1O Show InChI InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1 | PDB
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| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of p60c-src expressed in chick embryo fibroblast |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM4364
((3Z)-2-amino-3-[(4-hydroxyphenyl)methylidene]prop-...)Show InChI InChI=1S/C13H8N4O/c14-6-10(13(17)11(7-15)8-16)5-9-1-3-12(18)4-2-9/h1-5,11,17-18H | PDB
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| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50292521
(2-cyano-3-(3,4-dihydroxyphenyl)-N-(4-phenylbutyl)a...)Show InChI InChI=1S/C20H20N2O3/c21-14-17(12-16-9-10-18(23)19(24)13-16)20(25)22-11-5-4-8-15-6-2-1-3-7-15/h1-3,6-7,9-10,12-13,23-24H,4-5,8,11H2,(H,22,25)/b17-12- | PDB
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| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50007083
(3-Hydroxy-4-[4-(2-nitro-vinyl)-phenoxysulfonyl]-be...)Show SMILES OC(=O)c1ccc(c(O)c1)[S+]([O-])(=O)Oc1ccc(\C=C\[N+]([O-])=O)cc1 Show InChI InChI=1S/C15H11NO8S/c17-13-9-11(15(18)19)3-6-14(13)25(22,23)24-12-4-1-10(2-5-12)7-8-16(20)21/h1-9H,(H2-,17,18,19,22,23)/b8-7+ | PDB
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| n/a | n/a | 300 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50025622
(Psi-Tectorigenin)Show InChI InChI=1S/C16H12O6/c1-21-15-12(19)6-11(18)13-14(20)10(7-22-16(13)15)8-2-4-9(17)5-3-8/h2-7,17-19H,1H3 | PDB
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| n/a | n/a | 333 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50292511
(2-Cyano-3-(2'-hydroxy-[1,1';3',1'']terphenyl-5'-yl...)Show SMILES NC(=O)C(=C\c1cc(c(O)c(c1)-c1ccccc1)-c1ccccc1)\C#N Show InChI InChI=1S/C22H16N2O2/c23-14-18(22(24)26)11-15-12-19(16-7-3-1-4-8-16)21(25)20(13-15)17-9-5-2-6-10-17/h1-13,25H,(H2,24,26)/b18-11+ | PDB
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| n/a | n/a | 400 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50292508
(3-(4-hydroxy-3,5-bis(methylthiomethyl)benzylidene)...)Show InChI InChI=1S/C19H19NO2S2/c1-23-10-13-7-12(8-14(11-24-2)18(13)21)9-16-15-5-3-4-6-17(15)20-19(16)22/h3-9,21H,10-11H2,1-2H3,(H,20,22)/b16-9- | PDB
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| n/a | n/a | 400 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50065271
(3-(4-hydroxy-3,5-diisopropylbenzylidene)indolin-2-...)Show SMILES CC(C)c1cc(\C=C2/C(=O)Nc3ccccc23)cc(C(C)C)c1O Show InChI InChI=1S/C21H23NO2/c1-12(2)16-9-14(10-17(13(3)4)20(16)23)11-18-15-7-5-6-8-19(15)22-21(18)24/h5-13,23H,1-4H3,(H,22,24)/b18-11- | PDB
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| n/a | n/a | 400 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM4293
((2E)-3-(3,4-dihydroxyphenyl)-2-[(3,4-dihydroxyphen...)Show InChI InChI=1S/C16H11NO5/c17-8-11(5-9-1-3-12(18)14(20)6-9)16(22)10-2-4-13(19)15(21)7-10/h1-7,18-21H/b11-5+ | PDB
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TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50007072
(4-(2-nitrovinyl)phenyl 4-(methylcarbamoyl)benzenes...)Show SMILES CNC(=O)c1ccc(cc1)[S+]([O-])(=O)Oc1ccc(\C=C\[N+]([O-])=O)cc1 Show InChI InChI=1S/C16H14N2O6S/c1-17-16(19)13-4-8-15(9-5-13)25(22,23)24-14-6-2-12(3-7-14)10-11-18(20)21/h2-11H,1H3,(H-,17,19,22,23)/b11-10+ | PDB
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TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50292506
(CHEMBL485070 | ST-638 | alpha-cyano-3-ethoxy-4-hyd...)Show InChI InChI=1S/C19H18N2O3S/c1-2-24-17-10-13(8-14(11-20)19(21)23)9-15(18(17)22)12-25-16-6-4-3-5-7-16/h3-10,22H,2,12H2,1H3,(H2,21,23)/b14-8+ | PDB
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| n/a | n/a | 400 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50036694
((E)-2-Cyano-3-(4-hydroxy-3-methoxy-5-phenylsulfany...)Show InChI InChI=1S/C18H16N2O3S/c1-23-16-9-12(7-13(10-19)18(20)22)8-14(17(16)21)11-24-15-5-3-2-4-6-15/h2-9,21H,11H2,1H3,(H2,20,22)/b13-7+ | PDB
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| n/a | n/a | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50292501
(((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihyd...)Show SMILES COc1cc(\C=C\[N+]([O-])=O)ccc1O[S+]([O-])(=O)c1ccc(cc1)C(=O)OCC1OC(C(O)C1O)n1cnc2c(N)ncnc12 Show InChI InChI=1S/C26H24N6O11S/c1-40-18-10-14(8-9-32(36)37)2-7-17(18)43-44(38,39)16-5-3-15(4-6-16)26(35)41-11-19-21(33)22(34)25(42-19)31-13-30-20-23(27)28-12-29-24(20)31/h2-10,12-13,19,21-22,25,33-34H,11H2,1H3,(H2-,27,28,29,38,39)/b9-8+ | PDB
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TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM4369
((3Z)-2-amino-3-[(3-bromo-4,5-dihydroxyphenyl)methy...)Show SMILES Oc1cc(C=C(C#N)C(=N)C(C#N)C#N)cc(Br)c1O |w:4.3| Show InChI InChI=1S/C13H7BrN4O2/c14-10-2-7(3-11(19)13(10)20)1-8(4-15)12(18)9(5-16)6-17/h1-3,9,18-20H | PDB
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TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM4284
((5,6-Dihydroxyindanylidene)malononitrile | 2-(5,6-...)Show SMILES [#8]-c1cc2-[#6]-[#6]\[#6](=[#6](\C#N)C#N)-c2cc1-[#8] Show InChI InChI=1S/C12H8N2O2/c13-5-8(6-14)9-2-1-7-3-11(15)12(16)4-10(7)9/h3-4,15-16H,1-2H2 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50025591
(CHEMBL483831)Show SMILES OC(=O)c1ccc(O)c(c1)N(Cc1ccccc1O)Cc1cc(O)ccc1O Show InChI InChI=1S/C21H19NO6/c23-16-6-8-19(25)15(9-16)12-22(11-14-3-1-2-4-18(14)24)17-10-13(21(27)28)5-7-20(17)26/h1-10,23-26H,11-12H2,(H,27,28) | PDB
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| n/a | n/a | 524 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50292500
(((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihyd...)Show SMILES Nc1ncnc2n(cnc12)C1OC(COC(=O)c2ccc(cc2)[S+]([O-])(=O)Oc2ccc(\C=C\[N+]([O-])=O)cc2)C(O)C1O Show InChI InChI=1S/C25H22N6O10S/c26-22-19-23(28-12-27-22)30(13-29-19)24-21(33)20(32)18(40-24)11-39-25(34)15-3-7-17(8-4-15)42(37,38)41-16-5-1-14(2-6-16)9-10-31(35)36/h1-10,12-13,18,20-21,24,32-33H,11H2,(H2-,26,27,28,37,38)/b10-9+ | PDB
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TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM4294
((2E)-3-(3,4-dihydroxyphenyl)-2-[(4-fluorophenyl)ca...)Show InChI InChI=1S/C16H10FNO3/c17-13-4-2-11(3-5-13)16(21)12(9-18)7-10-1-6-14(19)15(20)8-10/h1-8,19-20H/b12-7+ | PDB
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TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50292513
(2-cyano-3-(3,5-dibenzyl-4-hydroxyphenyl)acrylamide...)Show SMILES NC(=O)C(=C/c1cc(Cc2ccccc2)c(O)c(Cc2ccccc2)c1)\C#N Show InChI InChI=1S/C24H20N2O2/c25-16-22(24(26)28)15-19-13-20(11-17-7-3-1-4-8-17)23(27)21(14-19)12-18-9-5-2-6-10-18/h1-10,13-15,27H,11-12H2,(H2,26,28)/b22-15- | PDB
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TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM4304
((2E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-phenylprop-...)Show InChI InChI=1S/C16H12N2O3/c17-10-12(8-11-6-7-14(19)15(20)9-11)16(21)18-13-4-2-1-3-5-13/h1-9,19-20H,(H,18,21)/b12-8+ | PDB
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| n/a | n/a | 700 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM4303
((2E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-(3-phenylpr...)Show InChI InChI=1S/C19H18N2O3/c20-13-16(11-15-8-9-17(22)18(23)12-15)19(24)21-10-4-7-14-5-2-1-3-6-14/h1-3,5-6,8-9,11-12,22-23H,4,7,10H2,(H,21,24)/b16-11+ | PDB
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TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50292514
(3-(3-(benzyloxy)-4-hydroxy-5-(phenylthiomethyl)phe...)Show SMILES NC(=O)C(=C\c1cc(CSc2ccccc2)c(O)c(OCc2ccccc2)c1)\C#N Show InChI InChI=1S/C24H20N2O3S/c25-14-19(24(26)28)11-18-12-20(16-30-21-9-5-2-6-10-21)23(27)22(13-18)29-15-17-7-3-1-4-8-17/h1-13,27H,15-16H2,(H2,26,28)/b19-11+ | PDB
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TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM4367
((3Z)-2-amino-3-[(3,4,5-trihydroxyphenyl)methyliden...)Show SMILES Oc1cc(C=C(C#N)C(=N)C(C#N)C#N)cc(O)c1O |w:4.3| Show InChI InChI=1S/C13H8N4O3/c14-4-8(12(17)9(5-15)6-16)1-7-2-10(18)13(20)11(19)3-7/h1-3,9,17-20H | PDB
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TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50292507
(3-(3-ethoxy-4-hydroxy-5-(phenylthiomethyl)benzylid...)Show InChI InChI=1S/C20H21NO3S/c1-2-24-18-12-14(10-15-8-9-21-20(15)23)11-16(19(18)22)13-25-17-6-4-3-5-7-17/h3-7,10-12,22H,2,8-9,13H2,1H3,(H,21,23)/b15-10- | PDB
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| n/a | n/a | 900 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM4306
((2E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-(2-phenylet...)Show InChI InChI=1S/C18H16N2O3/c19-12-15(10-14-6-7-16(21)17(22)11-14)18(23)20-9-8-13-4-2-1-3-5-13/h1-7,10-11,21-22H,8-9H2,(H,20,23)/b15-10+ | PDB
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TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM4295
((2E)-3-(3,4-dihydroxyphenyl)-2-[(4-methylphenyl)ca...)Show InChI InChI=1S/C17H13NO3/c1-11-2-5-13(6-3-11)17(21)14(10-18)8-12-4-7-15(19)16(20)9-12/h2-9,19-20H,1H3/b14-8+ | PDB
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TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50292512
(2-cyano-3-(4-hydroxy-3,5-diisopropylphenyl)acrylam...)Show InChI InChI=1S/C16H20N2O2/c1-9(2)13-6-11(5-12(8-17)16(18)20)7-14(10(3)4)15(13)19/h5-7,9-10,19H,1-4H3,(H2,18,20)/b12-5+ | PDB
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| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50025623
(CHEMBL1202061)Show SMILES OC(=O)C(O)=O.CCOC(=O)C(=O)Oc1ccc(cc1)-c1c(oc2cc(O)cc(O)c2c1=O)C(=O)OCC Show InChI InChI=1S/C22H18O10/c1-3-29-20(26)19-16(18(25)17-14(24)9-12(23)10-15(17)32-19)11-5-7-13(8-6-11)31-22(28)21(27)30-4-2/h5-10,23-24H,3-4H2,1-2H3 | PDB
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| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50007075
(4-(4-(2-nitrovinyl)phenoxysulfonyl)benzoic acid | ...)Show SMILES OC(=O)c1ccc(cc1)[S+]([O-])(=O)Oc1ccc(\C=C\[N+]([O-])=O)cc1 Show InChI InChI=1S/C15H11NO7S/c17-15(18)12-3-7-14(8-4-12)24(21,22)23-13-5-1-11(2-6-13)9-10-16(19)20/h1-10H,(H-,17,18,21,22)/b10-9+ | PDB
MMDB
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM4368
((3Z)-2-amino-3-[(3,4-dihydroxy-5-methoxyphenyl)met...)Show SMILES COc1cc(C=C(C#N)C(=N)C(C#N)C#N)cc(O)c1O |w:5.4| Show InChI InChI=1S/C14H10N4O3/c1-21-12-4-8(3-11(19)14(12)20)2-9(5-15)13(18)10(6-16)7-17/h2-4,10,18-20H,1H3 | PDB
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| PC cid
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Similars
| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase Lck
(Homo sapiens (Human)) | BDBM50011418
(2-(4-Amino-phenyl)-6-hydroxy-chromen-4-one | 2-(4-...)Show InChI InChI=1S/C15H11NO3/c16-10-3-1-9(2-4-10)15-8-13(18)12-7-11(17)5-6-14(12)19-15/h1-8,17H,16H2 | PDB
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| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of p56 lck |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM4296
((2E)-2-benzoyl-3-(3,4-dihydroxyphenyl)prop-2-eneni...)Show InChI InChI=1S/C16H11NO3/c17-10-13(16(20)12-4-2-1-3-5-12)8-11-6-7-14(18)15(19)9-11/h1-9,18-19H/b13-8+ | PDB
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| Purchase
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50007076
(4-(2-nitrovinyl)phenyl 4-(2-(tert-butoxycarbonylam...)Show SMILES CC(C)(C)OC(=O)NCCNC(=O)c1ccc(cc1)[S+]([O-])(=O)Oc1ccc(C=C[N+]([O-])=O)cc1 |w:27.27| Show InChI InChI=1S/C22H25N3O8S/c1-22(2,3)32-21(27)24-14-13-23-20(26)17-6-10-19(11-7-17)34(30,31)33-18-8-4-16(5-9-18)12-15-25(28)29/h4-12,15H,13-14H2,1-3H3,(H2-,23,24,26,27,30,31) | PDB
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| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50292502
(4-(2-nitrovinyl)phenyl 4-(isopropylcarbamoyl)benze...)Show SMILES CC(C)NC(=O)c1ccc(cc1)[S+]([O-])(=O)Oc1ccc(\C=C\[N+]([O-])=O)cc1 Show InChI InChI=1S/C18H18N2O6S/c1-13(2)19-18(21)15-5-9-17(10-6-15)27(24,25)26-16-7-3-14(4-8-16)11-12-20(22)23/h3-13H,1-2H3,(H-,19,21,24,25)/b12-11+ | PDB
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| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50025606
(LAVENDUSTIN B)Show InChI InChI=1S/C21H19NO5/c23-18-7-3-1-5-14(18)12-22(13-15-6-2-4-8-19(15)24)16-9-10-20(25)17(11-16)21(26)27/h1-11,23-25H,12-13H2,(H,26,27) | PDB
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| Article
PubMed
| n/a | n/a | 1.36E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50025503
(CHEMBL485485 | N-(2,3-Dihydroxystyryl)Formamide)Show InChI InChI=1S/C9H9NO3/c11-6-10-5-4-7-2-1-3-8(12)9(7)13/h1-6,12-13H,(H,10,11)/b5-4+ | PDB
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| CHEMBL
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PC sid
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| Article
PubMed
| n/a | n/a | 1.67E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of EGFR |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM4298
((2E)-3-(3,4-dihydroxyphenyl)-2-[(4-nitrophenyl)car...)Show SMILES Oc1ccc(\C=C(/C#N)C(=O)c2ccc(cc2)[N+]([O-])=O)cc1O Show InChI InChI=1S/C16H10N2O5/c17-9-12(7-10-1-6-14(19)15(20)8-10)16(21)11-2-4-13(5-3-11)18(22)23/h1-8,19-20H/b12-7+ | PDB
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| PC cid
PC sid
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| Article
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
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM4297
((2E)-2-[(2-chlorophenyl)carbonyl]-3-(3,4-dihydroxy...)Show InChI InChI=1S/C16H10ClNO3/c17-13-4-2-1-3-12(13)16(21)11(9-18)7-10-5-6-14(19)15(20)8-10/h1-8,19-20H/b11-7+ | PDB
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| PC cid
PC sid
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| Article
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
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50292524
(2-cyano-N-cyclohexyl-3-(3,4-dihydroxyphenyl)acryla...)Show InChI InChI=1S/C16H18N2O3/c17-10-12(8-11-6-7-14(19)15(20)9-11)16(21)18-13-4-2-1-3-5-13/h6-9,13,19-20H,1-5H2,(H,18,21)/b12-8- | PDB
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| Article
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| 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
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM4313
((2E)-N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-...)Show InChI InChI=1S/C17H14N2O3/c18-10-14(8-13-6-7-15(20)16(21)9-13)17(22)19-11-12-4-2-1-3-5-12/h1-9,20-21H,11H2,(H,19,22)/b14-8+ | PDB
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| Article
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| 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
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50007070
(2-Hydroxy-4-[4-(2-nitro-vinyl)-phenoxysulfonyl]-be...)Show SMILES COC(=O)c1ccc(cc1O)[S+]([O-])(=O)Oc1ccc(\C=C\[N+]([O-])=O)cc1 Show InChI InChI=1S/C16H13NO8S/c1-24-16(19)14-7-6-13(10-15(14)18)26(22,23)25-12-4-2-11(3-5-12)8-9-17(20)21/h2-10H,1H3,(H-,18,19,22,23)/b9-8+ | PDB
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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
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50007081
(4-[4-(2-Nitro-vinyl)-phenoxysulfonyl]-benzoic acid...)Show SMILES COC(=O)c1ccc(cc1)[S+]([O-])(=O)Oc1ccc(\C=C\[N+]([O-])=O)cc1 Show InChI InChI=1S/C16H13NO7S/c1-23-16(18)13-4-8-15(9-5-13)25(21,22)24-14-6-2-12(3-7-14)10-11-17(19)20/h2-11H,1H3/b11-10+ | PDB
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| CHEMBL
PC cid
PC sid
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| Article
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
Inhibition of EGFR in human A431 cells |
J Nat Prod 55: 1529-1560 (1992)
Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC |
More data for this
Ligand-Target Pair | |
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