Found 78 hits of ic50 for UniProtKB: P28347 Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kcal/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626350
(2-[[[4-cyano-7-(4-isopropyl-2- thienyl)-2,3-dihyd...)Show SMILES CC(C)c1csc(c1)-c1cc(NCC(=C)C(O)=O)c(C#N)c2CCOc12 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| | n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626318
(2-[[[4-cyano-7-(4-isopropylphenyl)- 2,3-dihydrobe...)Show SMILES CC(C)c1ccc(cc1)-c1cc(NCC(=C)C(O)=O)c(C#N)c2CCOc12 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626331
(US11787775, Compound 16-C)Show SMILES C[C@@H](c1ccc(cc1)-c1cc(NCC(=C)C(O)=O)c(C#N)c2CCOc12)C(F)(F)F |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626318
(2-[[[4-cyano-7-(4-isopropylphenyl)- 2,3-dihydrobe...)Show SMILES CC(C)c1ccc(cc1)-c1cc(NCC(=C)C(O)=O)c(C#N)c2CCOc12 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM50271260
(CHEMBL4130196)Show SMILES CCCC[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSSC[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C1=O)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(N)=O)NC(=O)[C@H](Cc1cccc(Cl)c1)NC(C)[C@@H]1CCCN1C(=O)[C@@H](NC(C)=O)C(C)C |r| Show InChI InChI=1S/C94H148ClN23O20S2/c1-9-10-28-65-90(135)116-43-21-33-73(116)88(133)103-56(7)79(124)113-70(51-119)86(131)112-69(49-58-24-12-11-13-25-58)85(130)114-71(87(132)110-66(30-15-17-40-97)91(136)118-45-23-35-75(118)92(137)117-44-22-34-74(117)89(134)105-61(78(98)123)36-37-76(121)122)52-140-139-46-38-64(82(127)111-67(47-53(2)3)83(128)107-63(31-19-41-101-94(99)100)80(125)106-62(81(126)109-65)29-14-16-39-96)108-84(129)68(50-59-26-18-27-60(95)48-59)102-55(6)72-32-20-42-115(72)93(138)77(54(4)5)104-57(8)120/h11-13,18,24-27,48,53-56,61-75,77,102,119H,9-10,14-17,19-23,28-47,49-52,96-97H2,1-8H3,(H2,98,123)(H,103,133)(H,104,120)(H,105,134)(H,106,125)(H,107,128)(H,108,129)(H,109,126)(H,110,132)(H,111,127)(H,112,131)(H,113,124)(H,114,130)(H,121,122)(H4,99,100,101)/t55?,56-,61-,62-,63-,64-,65-,66-,67-,68-,69+,70-,71-,72-,73-,74-,75-,77-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/a |
Universities of Lille
Curated by ChEMBL
| Assay Description
Inhibition of human His-tagged YAP (50 to 171 residues) interaction with human GST-tagged TEAD1 (194 to 411) expressed in Escherichia coli BL21(DE3) ... |
J Med Chem 61: 5057-5072 (2018)
Article DOI: 10.1021/acs.jmedchem.7b00879
BindingDB Entry DOI: 10.7270/Q22B91H7 |
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM50497300
(CHEMBL3335461)Show SMILES [H][C@@]12CCCN1C(=O)[C@H](CCCC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSSC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC2=O)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(N)=O)NC(=O)[C@H](Cc1cccc(Cl)c1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(C)=O)C(C)C |r| Show InChI InChI=1S/C93H144ClN23O21S2/c1-8-9-27-63-89(135)114-41-19-31-70(114)86(132)101-54(6)77(123)112-68(50-118)84(130)110-66(48-56-23-11-10-12-24-56)83(129)113-69(85(131)108-64(29-14-16-39-96)90(136)117-44-22-34-73(117)91(137)115-42-20-32-71(115)87(133)103-59(76(97)122)35-36-74(120)121)51-140-139-45-37-62(80(126)109-65(46-52(2)3)81(127)105-61(30-18-40-100-93(98)99)78(124)104-60(79(125)107-63)28-13-15-38-95)106-82(128)67(49-57-25-17-26-58(94)47-57)111-88(134)72-33-21-43-116(72)92(138)75(53(4)5)102-55(7)119/h10-12,17,23-26,47,52-54,59-73,75,118H,8-9,13-16,18-22,27-46,48-51,95-96H2,1-7H3,(H2,97,122)(H,101,132)(H,102,119)(H,103,133)(H,104,124)(H,105,127)(H,106,128)(H,107,125)(H,108,131)(H,109,126)(H,110,130)(H,111,134)(H,112,123)(H,113,129)(H,120,121)(H4,98,99,100)/t54-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,75-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Innovation Center Shanghai
Curated by ChEMBL
| Assay Description
Inhibition of YAP/ GST-TEAD1 (unknown origin) interaction by surface plasmon resonance assay |
ACS Med Chem Lett 5: 993-8 (2014)
Article DOI: 10.1021/ml500160m
BindingDB Entry DOI: 10.7270/Q28P63H7 |
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626361
(2-[[[4-cyano-7-[4-(pentafluoro- lambda6-sulfanyl)...)Show SMILES OC(=O)C(=C)CNc1cc(c2OCCc2c1C#N)-c1ccc(cc1)S(F)(F)(F)(F)F | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626333
(2-[[[4-cyano-7-[4- (trifluoromethoxy)phenyl]-2,3-...)Show SMILES OC(=O)C(=C)CNc1cc(c2OCCc2c1C#N)-c1ccc(OC(F)(F)F)cc1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626354
(2-[[[4-cyano-2,2-dideuterio-7-[4- (trifluorometho...)Show SMILES ONC(=O)C(=C)CNc1cc(c2OCCc2c1C#N)-c1ccc(OC(F)(F)F)cc1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM50497290
(CHEMBL3335458)Show SMILES [H][C@@]12CCCN1C(=O)[C@H](CCCC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSSC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC2=O)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(N)=O)NC(=O)[C@H](CCCCC)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(C)=O)C(C)C |r| Show InChI InChI=1S/C91H149N23O21S2/c1-9-11-14-29-59(104-86(131)70-35-24-45-113(70)90(135)73(53(5)6)99-55(8)116)76(121)103-61-39-47-136-137-51-67(83(128)106-63(31-18-20-41-93)88(133)114-46-25-36-71(114)89(134)112-44-23-34-69(112)85(130)100-57(74(94)119)37-38-72(117)118)110-81(126)65(49-56-26-15-13-16-27-56)108-82(127)66(50-115)109-75(120)54(7)98-84(129)68-33-22-43-111(68)87(132)62(28-12-10-2)105-78(123)58(30-17-19-40-92)101-77(122)60(32-21-42-97-91(95)96)102-80(125)64(48-52(3)4)107-79(61)124/h13,15-16,26-27,52-54,57-71,73,115H,9-12,14,17-25,28-51,92-93H2,1-8H3,(H2,94,119)(H,98,129)(H,99,116)(H,100,130)(H,101,122)(H,102,125)(H,103,121)(H,104,131)(H,105,123)(H,106,128)(H,107,124)(H,108,127)(H,109,120)(H,110,126)(H,117,118)(H4,95,96,97)/t54-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,73-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 41 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Innovation Center Shanghai
Curated by ChEMBL
| Assay Description
Inhibition of YAP/ GST-TEAD1 (unknown origin) interaction by surface plasmon resonance assay |
ACS Med Chem Lett 5: 993-8 (2014)
Article DOI: 10.1021/ml500160m
BindingDB Entry DOI: 10.7270/Q28P63H7 |
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM50497304
(CHEMBL3335453)Show SMILES [H][C@@]12CCCN1C(=O)[C@H](CCCCC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSSC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC2=O)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(C)=O)C(C)C |r| Show InChI InChI=1S/C90H147N23O21S3/c1-9-10-12-27-61-86(131)110-41-20-30-67(110)83(128)97-53(6)74(119)108-65(49-114)81(126)107-64(48-55-24-13-11-14-25-55)80(125)109-66(82(127)105-62(28-16-18-39-92)87(132)113-44-23-33-70(113)88(133)111-42-21-31-68(111)84(129)99-56(73(93)118)34-35-71(116)117)50-137-136-46-37-60(102-77(122)59(36-45-135-8)103-85(130)69-32-22-43-112(69)89(134)72(52(4)5)98-54(7)115)78(123)106-63(47-51(2)3)79(124)101-58(29-19-40-96-90(94)95)75(120)100-57(76(121)104-61)26-15-17-38-91/h11,13-14,24-25,51-53,56-70,72,114H,9-10,12,15-23,26-50,91-92H2,1-8H3,(H2,93,118)(H,97,128)(H,98,115)(H,99,129)(H,100,120)(H,101,124)(H,102,122)(H,103,130)(H,104,121)(H,105,127)(H,106,123)(H,107,126)(H,108,119)(H,109,125)(H,116,117)(H4,94,95,96)/t53-,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,72-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 42 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Innovation Center Shanghai
Curated by ChEMBL
| Assay Description
Inhibition of YAP/ GST-TEAD1 (unknown origin) interaction by surface plasmon resonance assay |
ACS Med Chem Lett 5: 993-8 (2014)
Article DOI: 10.1021/ml500160m
BindingDB Entry DOI: 10.7270/Q28P63H7 |
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626334
(2-[[[4-cyano-7-[4-(1,1- difluoroethyl)phenyl]-2,3...)Show SMILES CC(F)(F)c1ccc(cc1)-c1cc(NCC(=C)C(O)=O)c(C#N)c2CCOc12 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626342
(2-[[[4-cyano-7-(2-fluoro-4- isopropyl-phenyl)-2,3...)Show SMILES CC(C)c1ccc(c(F)c1)-c1cc(NCC(=C)C(O)=O)c(C#N)c2CCOc12 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626354
(2-[[[4-cyano-2,2-dideuterio-7-[4- (trifluorometho...)Show SMILES ONC(=O)C(=C)CNc1cc(c2OCCc2c1C#N)-c1ccc(OC(F)(F)F)cc1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626330
(2-[[[4-cyano-7-[4- (trifluoromethyl)phenyl]-2,3- ...)Show SMILES OC(=O)C(=C)CNc1cc(c2OCCc2c1C#N)-c1ccc(cc1)C(F)(F)F | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626362
(2-[[[4-(hydroxymethyl)-7-[4- (trifluoromethoxy)ph...)Show SMILES OCc1c2CCOc2c(cc1NCC(=C)C(=O)NO)-c1ccc(OC(F)(F)F)cc1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626324
(2-[[[4-cyano-7-(4-isopropylphenyl)- 2,3-dihydrobe...)Show SMILES CC(C)c1ccc(cc1)-c1cc(NCC(=C)C(=O)NO)c(C#N)c2CCOc12 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626336
(2-[[[4-fluoro-7-(4-isopropylphenyl)- 2,3-dihydrob...)Show SMILES CC(C)c1ccc(cc1)-c1cc(NCC(=C)C(O)=O)c(F)c2CCOc12 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626323
(US11787775, Compound 8 | methyl 2-[[[4-cyano-7-(4-...)Show SMILES COC(=O)C(=C)CNc1cc(c2OCCc2c1C#N)-c1ccc(cc1)C(C)C | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM50497306
(CHEMBL3335463)Show SMILES [H][C@@]12CCCN1C(=O)[C@H](CCCC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSSC[C@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC2=O)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(C)=O)C(C)C |r| Show InChI InChI=1S/C89H144FN23O21S3/c1-9-10-20-60-85(131)110-39-16-24-66(110)82(128)97-51(6)73(119)108-64(47-114)80(126)107-63(46-53-28-30-54(90)31-29-53)79(125)109-65(81(127)105-61(22-12-14-37-92)86(132)113-42-19-27-69(113)87(133)111-40-17-25-67(111)83(129)99-55(72(93)118)32-33-70(116)117)48-137-136-44-35-59(102-76(122)58(34-43-135-8)103-84(130)68-26-18-41-112(68)88(134)71(50(4)5)98-52(7)115)77(123)106-62(45-49(2)3)78(124)101-57(23-15-38-96-89(94)95)74(120)100-56(75(121)104-60)21-11-13-36-91/h28-31,49-51,55-69,71,114H,9-27,32-48,91-92H2,1-8H3,(H2,93,118)(H,97,128)(H,98,115)(H,99,129)(H,100,120)(H,101,124)(H,102,122)(H,103,130)(H,104,121)(H,105,127)(H,106,123)(H,107,126)(H,108,119)(H,109,125)(H,116,117)(H4,94,95,96)/t51-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,71-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 75 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Innovation Center Shanghai
Curated by ChEMBL
| Assay Description
Inhibition of YAP/ GST-TEAD1 (unknown origin) interaction by surface plasmon resonance assay |
ACS Med Chem Lett 5: 993-8 (2014)
Article DOI: 10.1021/ml500160m
BindingDB Entry DOI: 10.7270/Q28P63H7 |
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626332
(US11787775, Compound 16-D)Show SMILES C[C@H](c1ccc(cc1)-c1cc(NCC(=C)C(O)=O)c(C#N)c2CCOc12)C(F)(F)F |r| | PDB
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| | n/a | n/a | 80 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
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More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626358
(2-[[[7-cyano-4-[4- (trifluoromethoxy)phenyl]-1,3-...)Show SMILES ONC(=O)C(=C)CNc1cc(-c2ccc(OC(F)(F)F)cc2)c2ncsc2c1C#N | PDB
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TBA
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Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM50271259
(CHEMBL4129172)Show SMILES O=C(CSc1nnc[nH]1)Nc1ccc(cc1)C1C2CC3CC(C2)CC1C3 |TLB:13:16:18.25.19:23.21.22,25:24:22:18.19.20,THB:13:16:22:18.19.20,25:19:16.24.23:22,20:19:16:23.21.22,20:21:16:18.25.19,(23.85,-32.36,;23.85,-30.82,;22.52,-30.05,;21.19,-30.82,;19.85,-30.05,;19.35,-28.6,;17.81,-28.62,;17.37,-30.1,;18.63,-30.98,;25.19,-30.05,;26.52,-30.82,;26.52,-32.37,;27.85,-33.14,;29.19,-32.37,;29.18,-30.82,;27.85,-30.06,;30.52,-33.13,;31.72,-31.86,;33.05,-32.35,;34.44,-32,;34.45,-30.47,;33.06,-29.89,;31.71,-30.37,;32.02,-31.13,;32.02,-32.71,;33.43,-33.28,)| Show InChI InChI=1S/C20H24N4OS/c25-18(10-26-20-21-11-22-24-20)23-17-3-1-14(2-4-17)19-15-6-12-5-13(8-15)9-16(19)7-12/h1-4,11-13,15-16,19H,5-10H2,(H,23,25)(H,21,22,24) | PDB
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| Article
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Universities of Lille
Curated by ChEMBL
| Assay Description
Inhibition of Gal4-fused TEAD 1 (unknown origin) interaction with YAP expressed in human 293T cells by Dual-Glo luciferase reporter gene assay |
J Med Chem 61: 5057-5072 (2018)
Article DOI: 10.1021/acs.jmedchem.7b00879
BindingDB Entry DOI: 10.7270/Q22B91H7 |
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626337
(2-[[[4-cyano-7-(4-isopropylphenyl)- 2,3-dihydrofu...)Show SMILES CC(C)c1ccc(cc1)-c1nc(NCC(=C)C(O)=O)c(C#N)c2CCOc12 | PDB
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Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626355
(2-[[[4-cyano-7-[4-(pentafluoro- lambda6-sulfanyl)...)Show SMILES ONC(=O)C(=C)CNc1cc(c2OCCc2c1C#N)-c1ccc(cc1)S(F)(F)(F)(F)F | PDB
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Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626360
(2-[[[4-cyano-7-[4- (trifluoromethoxy)phenyl]-2,3-...)Show SMILES NC(=O)C(=C)CNc1cc(c2OCCc2c1C#N)-c1ccc(OC(F)(F)F)cc1 | PDB
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Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM50497296
(CHEMBL3335452)Show SMILES [H][C@@]12CCCN1C(=O)[C@H](CCCC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSSC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC2=O)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(C)=O)C(C)C |r| Show InChI InChI=1S/C89H145N23O21S3/c1-9-10-25-60-85(130)109-40-19-29-66(109)82(127)96-52(6)73(118)107-64(48-113)80(125)106-63(47-54-23-12-11-13-24-54)79(124)108-65(81(126)104-61(27-15-17-38-91)86(131)112-43-22-32-69(112)87(132)110-41-20-30-67(110)83(128)98-55(72(92)117)33-34-70(115)116)49-136-135-45-36-59(101-76(121)58(35-44-134-8)102-84(129)68-31-21-42-111(68)88(133)71(51(4)5)97-53(7)114)77(122)105-62(46-50(2)3)78(123)100-57(28-18-39-95-89(93)94)74(119)99-56(75(120)103-60)26-14-16-37-90/h11-13,23-24,50-52,55-69,71,113H,9-10,14-22,25-49,90-91H2,1-8H3,(H2,92,117)(H,96,127)(H,97,114)(H,98,128)(H,99,119)(H,100,123)(H,101,121)(H,102,129)(H,103,120)(H,104,126)(H,105,122)(H,106,125)(H,107,118)(H,108,124)(H,115,116)(H4,93,94,95)/t52-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,71-/m0/s1 | PDB
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| Article
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Roche Innovation Center Shanghai
Curated by ChEMBL
| Assay Description
Inhibition of YAP/ GST-TEAD1 (unknown origin) interaction by surface plasmon resonance assay |
ACS Med Chem Lett 5: 993-8 (2014)
Article DOI: 10.1021/ml500160m
BindingDB Entry DOI: 10.7270/Q28P63H7 |
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626338
(2-[[[7-cyano-4-[4-(1,1- difluoroethyl)phenyl]-1,3...)Show SMILES CC(F)(F)c1ccc(cc1)-c1cc(NCC(=C)C(O)=O)c(C#N)c2scnc12 | PDB
UniProtKB/SwissProt
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| PC cid
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| | n/a | n/a | 160 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
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Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626352
(2-[[[4-(hydroxymethyl)-7-[4- (trifluoromethoxy)ph...)Show SMILES NC(=O)C(=C)CNc1cc(c2OCCc2c1CO)-c1ccc(OC(F)(F)F)cc1 | PDB
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| PC cid
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| | n/a | n/a | 160 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
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More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626319
(2-[[[4-cyano-7-(4-isopropylphenyl)- 2,3-dihydrobe...)Show SMILES CC(C)c1ccc(cc1)-c1cc(NCC(=C)C(N)=O)c(C#N)c2CCOc12 | PDB
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TBA
| |
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More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626326
(7-(4-isopropylphenyl)-5-[(2- methylene-3-oxo-buty...)Show SMILES CC(C)c1ccc(cc1)-c1cc(NCC(=C)C(C)=O)c(C#N)c2CCOc12 | PDB
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TBA
| |
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More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626335
(2-[[[4-(4-isopropylphenyl)-6,7- dihydrofuro[3,2-d...)Show SMILES CC(C)c1ccc(cc1)-c1nc(NCC(=C)C(O)=O)nc2CCOc12 | PDB
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TBA
| |
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More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626365
(2-[[[7-cyano-4-[4-(pentafluoro- lambda6-sulfanyl)...)Show SMILES ONC(=O)C(=C)CNc1cc(-c2ccc(cc2)S(F)(F)(F)(F)F)c2ncsc2c1C#N | PDB
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TBA
| |
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More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626316
(2-[[[7-(4-isopropylphenyl)-2,3- dihydrobenzofuran...)Show SMILES CC(C)c1ccc(cc1)-c1cc(NCC(=C)C(O)=O)cc2CCOc12 | PDB
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TBA
| |
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More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626363
(2-[[[4-cyano-7-[4-(pentafluoro- lambda6-sulfanyl)...)Show SMILES NC(=O)C(=C)CNc1cc(c2OCCc2c1C#N)-c1ccc(cc1)S(F)(F)(F)(F)F | PDB
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| |
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More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626324
(2-[[[4-cyano-7-(4-isopropylphenyl)- 2,3-dihydrobe...)Show SMILES CC(C)c1ccc(cc1)-c1cc(NCC(=C)C(=O)NO)c(C#N)c2CCOc12 | PDB
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Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626347
(2-[[[4-cyano-7-(5-isopropylthiazol- 2-yl)-2,3-dih...)Show SMILES CC(C)c1cnc(s1)-c1cc(NCC(=C)C(=O)NO)c(C#N)c2CCOc12 | PDB
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More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM50497288
(CHEMBL3335456)Show SMILES [H][C@@]12CCCN1C(=O)[C@H](CCCC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSSC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC2=O)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(C)=O)C(C)C |r| Show InChI InChI=1S/C91H149N23O21S3/c1-51(2)23-17-28-63-87(132)111-41-19-30-68(111)84(129)98-54(7)75(120)109-66(49-115)82(127)108-65(48-56-24-11-10-12-25-56)81(126)110-67(83(128)106-62(27-14-16-39-93)88(133)114-44-22-33-71(114)89(134)112-42-20-31-69(112)85(130)100-57(74(94)119)34-35-72(117)118)50-138-137-46-37-61(103-78(123)60(36-45-136-9)104-86(131)70-32-21-43-113(70)90(135)73(53(5)6)99-55(8)116)79(124)107-64(47-52(3)4)80(125)102-59(29-18-40-97-91(95)96)76(121)101-58(77(122)105-63)26-13-15-38-92/h10-12,24-25,51-54,57-71,73,115H,13-23,26-50,92-93H2,1-9H3,(H2,94,119)(H,98,129)(H,99,116)(H,100,130)(H,101,121)(H,102,125)(H,103,123)(H,104,131)(H,105,122)(H,106,128)(H,107,124)(H,108,127)(H,109,120)(H,110,126)(H,117,118)(H4,95,96,97)/t54-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,73-/m0/s1 | PDB
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| Article
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| n/a | n/a | 310 | n/a | n/a | n/a | n/a | n/a | n/a |
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Curated by ChEMBL
| Assay Description
Inhibition of YAP/ GST-TEAD1 (unknown origin) interaction by surface plasmon resonance assay |
ACS Med Chem Lett 5: 993-8 (2014)
Article DOI: 10.1021/ml500160m
BindingDB Entry DOI: 10.7270/Q28P63H7 |
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626364
(2-[[[4-cyano-7-(5-isopropylthiazol- 2-yl)-2,3-dih...)Show SMILES CC(C)c1cnc(s1)-c1cc(NCC(=C)C(O)=O)c(C#N)c2CCOc12 | PDB
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| PC cid
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| | n/a | n/a | 310 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626319
(2-[[[4-cyano-7-(4-isopropylphenyl)- 2,3-dihydrobe...)Show SMILES CC(C)c1ccc(cc1)-c1cc(NCC(=C)C(N)=O)c(C#N)c2CCOc12 | PDB
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| | n/a | n/a | 320 | n/a | n/a | n/a | n/a | n/a | n/a |
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| |
Citation and Details
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More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM50497308
(CHEMBL3335457)Show SMILES [H][C@@]12CCCN1C(=O)[C@H](CCCC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSSC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC2=O)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(N)=O)NC(=O)[C@H](CCCC)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(C)=O)C(C)C |r| Show InChI InChI=1S/C90H147N23O21S2/c1-9-11-27-57(103-85(130)69-34-23-44-112(69)89(134)72(52(5)6)98-54(8)115)75(120)102-60-38-46-135-136-50-66(82(127)105-62(30-17-19-40-92)87(132)113-45-24-35-70(113)88(133)111-43-22-33-68(111)84(129)99-56(73(93)118)36-37-71(116)117)109-80(125)64(48-55-25-14-13-15-26-55)107-81(126)65(49-114)108-74(119)53(7)97-83(128)67-32-21-42-110(67)86(131)61(28-12-10-2)104-77(122)58(29-16-18-39-91)100-76(121)59(31-20-41-96-90(94)95)101-79(124)63(47-51(3)4)106-78(60)123/h13-15,25-26,51-53,56-70,72,114H,9-12,16-24,27-50,91-92H2,1-8H3,(H2,93,118)(H,97,128)(H,98,115)(H,99,129)(H,100,121)(H,101,124)(H,102,120)(H,103,130)(H,104,122)(H,105,127)(H,106,123)(H,107,126)(H,108,119)(H,109,125)(H,116,117)(H4,94,95,96)/t53-,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,72-/m0/s1 | PDB
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| Article
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| n/a | n/a | 340 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Innovation Center Shanghai
Curated by ChEMBL
| Assay Description
Inhibition of YAP/ GST-TEAD1 (unknown origin) interaction by surface plasmon resonance assay |
ACS Med Chem Lett 5: 993-8 (2014)
Article DOI: 10.1021/ml500160m
BindingDB Entry DOI: 10.7270/Q28P63H7 |
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM50497297
(CHEMBL3335459)Show SMILES [H][C@@]12CCCN1C(=O)[C@H](CCCC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSSC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC2=O)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(C)=O)C(C)C |r| Show InChI InChI=1S/C93H145N23O21S2/c1-8-9-29-63-89(134)113-43-21-33-70(113)86(131)100-55(6)77(122)111-68(51-117)84(129)109-66(49-57-25-12-10-13-26-57)83(128)112-69(85(130)107-64(31-17-19-41-95)90(135)116-46-24-36-73(116)91(136)114-44-22-34-71(114)87(132)102-59(76(96)121)37-38-74(119)120)52-139-138-47-39-62(105-82(127)67(50-58-27-14-11-15-28-58)110-88(133)72-35-23-45-115(72)92(137)75(54(4)5)101-56(7)118)80(125)108-65(48-53(2)3)81(126)104-61(32-20-42-99-93(97)98)78(123)103-60(79(124)106-63)30-16-18-40-94/h10-15,25-28,53-55,59-73,75,117H,8-9,16-24,29-52,94-95H2,1-7H3,(H2,96,121)(H,100,131)(H,101,118)(H,102,132)(H,103,123)(H,104,126)(H,105,127)(H,106,124)(H,107,130)(H,108,125)(H,109,129)(H,110,133)(H,111,122)(H,112,128)(H,119,120)(H4,97,98,99)/t55-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,75-/m0/s1 | PDB
UniProtKB/SwissProt
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| n/a | n/a | 350 | n/a | n/a | n/a | n/a | n/a | n/a |
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Curated by ChEMBL
| Assay Description
Inhibition of YAP/ GST-TEAD1 (unknown origin) interaction by surface plasmon resonance assay |
ACS Med Chem Lett 5: 993-8 (2014)
Article DOI: 10.1021/ml500160m
BindingDB Entry DOI: 10.7270/Q28P63H7 |
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM50497289
(CHEMBL3335454)Show SMILES [H][C@@]12CCCN1C(=O)[C@H](CCCCCC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSSC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC2=O)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(C)=O)C(C)C |r| Show InChI InChI=1S/C91H149N23O21S3/c1-9-10-11-15-28-62-87(132)111-42-21-31-68(111)84(129)98-54(6)75(120)109-66(50-115)82(127)108-65(49-56-25-13-12-14-26-56)81(126)110-67(83(128)106-63(29-17-19-40-93)88(133)114-45-24-34-71(114)89(134)112-43-22-32-69(112)85(130)100-57(74(94)119)35-36-72(117)118)51-138-137-47-38-61(103-78(123)60(37-46-136-8)104-86(131)70-33-23-44-113(70)90(135)73(53(4)5)99-55(7)116)79(124)107-64(48-52(2)3)80(125)102-59(30-20-41-97-91(95)96)76(121)101-58(77(122)105-62)27-16-18-39-92/h12-14,25-26,52-54,57-71,73,115H,9-11,15-24,27-51,92-93H2,1-8H3,(H2,94,119)(H,98,129)(H,99,116)(H,100,130)(H,101,121)(H,102,125)(H,103,123)(H,104,131)(H,105,122)(H,106,128)(H,107,124)(H,108,127)(H,109,120)(H,110,126)(H,117,118)(H4,95,96,97)/t54-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,73-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 370 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Innovation Center Shanghai
Curated by ChEMBL
| Assay Description
Inhibition of YAP/ GST-TEAD1 (unknown origin) interaction by surface plasmon resonance assay |
ACS Med Chem Lett 5: 993-8 (2014)
Article DOI: 10.1021/ml500160m
BindingDB Entry DOI: 10.7270/Q28P63H7 |
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626344
(2-[[[7-cyano-4-[4- (trifluoromethoxy)phenyl]-1,3-...)Show SMILES NC(=O)C(=C)CNc1cc(-c2ccc(OC(F)(F)F)cc2)c2ncsc2c1C#N | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 370 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM50497302
(CHEMBL3335460)Show SMILES [H][C@@]12CCCN1C(=O)[C@H](CCCC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSSC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC2=O)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(N)=O)NC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(C)=O)C(C)C |r| Show InChI InChI=1S/C93H144ClN23O21S2/c1-8-9-28-63-89(135)114-42-20-32-70(114)86(132)101-54(6)77(123)112-68(50-118)84(130)110-66(48-56-24-11-10-12-25-56)82(128)113-69(85(131)108-64(30-16-18-40-96)90(136)117-45-23-35-73(117)91(137)115-43-21-33-71(115)87(133)103-59(76(97)122)36-37-74(120)121)51-140-139-46-38-62(80(126)109-65(47-52(2)3)81(127)105-61(31-19-41-100-93(98)99)78(124)104-60(79(125)107-63)29-15-17-39-95)106-83(129)67(49-57-26-13-14-27-58(57)94)111-88(134)72-34-22-44-116(72)92(138)75(53(4)5)102-55(7)119/h10-14,24-27,52-54,59-73,75,118H,8-9,15-23,28-51,95-96H2,1-7H3,(H2,97,122)(H,101,132)(H,102,119)(H,103,133)(H,104,124)(H,105,127)(H,106,129)(H,107,125)(H,108,131)(H,109,126)(H,110,130)(H,111,134)(H,112,123)(H,113,128)(H,120,121)(H4,98,99,100)/t54-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,75-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 380 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Innovation Center Shanghai
Curated by ChEMBL
| Assay Description
Inhibition of YAP/ GST-TEAD1 (unknown origin) interaction by surface plasmon resonance assay |
ACS Med Chem Lett 5: 993-8 (2014)
Article DOI: 10.1021/ml500160m
BindingDB Entry DOI: 10.7270/Q28P63H7 |
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626359
(2-[[[4-cyano-7-[4- (trifluoromethoxy)phenyl]-2,3-...)Show SMILES CN(O)C(=O)C(=C)CNc1cc(c2OCCc2c1C#N)-c1ccc(OC(F)(F)F)cc1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 400 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626329
(2-[[[4-(hydroxymethyl)-7-(4- isopropylphenyl)-2,3...)Show SMILES CC(C)c1ccc(cc1)-c1cc(NCC(=C)C(=O)NO)c(CO)c2CCOc12 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 520 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM50497309
(CHEMBL3335462)Show SMILES [H][C@@]12CCCN1C(=O)[C@H](CCCC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSSC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC2=O)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(N)=O)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(C)=O)C(C)C |r| Show InChI InChI=1S/C93H144ClN23O21S2/c1-8-9-24-63-89(135)114-42-18-28-70(114)86(132)101-54(6)77(123)112-68(50-118)84(130)110-66(48-56-22-11-10-12-23-56)83(129)113-69(85(131)108-64(26-14-16-40-96)90(136)117-45-21-31-73(117)91(137)115-43-19-29-71(115)87(133)103-59(76(97)122)36-37-74(120)121)51-140-139-46-38-62(80(126)109-65(47-52(2)3)81(127)105-61(27-17-41-100-93(98)99)78(124)104-60(79(125)107-63)25-13-15-39-95)106-82(128)67(49-57-32-34-58(94)35-33-57)111-88(134)72-30-20-44-116(72)92(138)75(53(4)5)102-55(7)119/h10-12,22-23,32-35,52-54,59-73,75,118H,8-9,13-21,24-31,36-51,95-96H2,1-7H3,(H2,97,122)(H,101,132)(H,102,119)(H,103,133)(H,104,124)(H,105,127)(H,106,128)(H,107,125)(H,108,131)(H,109,126)(H,110,130)(H,111,134)(H,112,123)(H,113,129)(H,120,121)(H4,98,99,100)/t54-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,75-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 530 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Innovation Center Shanghai
Curated by ChEMBL
| Assay Description
Inhibition of YAP/ GST-TEAD1 (unknown origin) interaction by surface plasmon resonance assay |
ACS Med Chem Lett 5: 993-8 (2014)
Article DOI: 10.1021/ml500160m
BindingDB Entry DOI: 10.7270/Q28P63H7 |
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626322
(2-[[[4-cyano-7-(4-isopropylphenyl)- 2,3-dihydrobe...)Show SMILES CC(C)c1ccc(cc1)-c1cc(N(C)CC(=C)C(O)=O)c(C#N)c2CCOc12 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 540 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Transcriptional enhancer factor TEF-1
(Homo sapiens) | BDBM626339
(2-[[[6-methoxy-5-[(E)-2-[trans-4- (trifluoromethy...)Show SMILES COc1ncc(NCC(=C)C(O)=O)cc1\C=C\[C@H]1CC[C@@H](CC1)C(F)(F)F |r,wU:17.17,wD:20.24,(3.33,3.85,;2,4.62,;.67,3.85,;-.67,4.62,;-2,3.85,;-2,2.31,;-3.33,1.54,;-4.67,2.31,;-6,1.54,;-6,,;-7.34,2.31,;-8.67,1.54,;-7.34,3.85,;-.67,1.54,;.67,2.31,;2,1.54,;2,,;3.33,-.77,;4.67,,;6,-.77,;6,-2.31,;4.67,-3.08,;3.33,-2.31,;7.34,-3.08,;8.67,-2.31,;7.34,-4.62,;8.67,-3.85,)| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 580 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
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