Found 7 hits with Last Name = 'muguruma' and Initial = 'k' 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 |
|---|
Growth/differentiation factor 8
(Homo sapiens (Human)) | BDBM50254771
(CHEMBL4061416)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)COc1ccc2ccccc2c1)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(N)=O |r| Show InChI InChI=1S/C139H225N41O33/c1-16-73(10)108(131(208)166-94(50-53-104(143)186)123(200)177-112(77(14)20-5)134(211)179-111(76(13)19-4)133(210)174-102(69-182)129(206)161-88(37-25-27-55-140)117(194)169-97(62-72(8)9)124(201)160-90(40-30-58-155-137(148)149)116(193)168-96(114(145)191)61-71(6)7)175-121(198)89(38-26-28-56-141)164-130(207)110(75(12)18-3)178-126(203)99(65-82-67-158-86-36-24-23-35-85(82)86)171-120(197)95(51-54-107(189)190)167-132(209)109(74(11)17-2)176-122(199)92(42-32-60-157-139(152)153)162-128(205)101(68-181)173-125(202)98(63-79-43-46-83(184)47-44-79)170-118(195)91(41-31-59-156-138(150)151)165-135(212)113(78(15)183)180-127(204)100(66-105(144)187)172-119(196)93(49-52-103(142)185)163-115(192)87(39-29-57-154-136(146)147)159-106(188)70-213-84-48-45-80-33-21-22-34-81(80)64-84/h21-24,33-36,43-48,64,67,71-78,87-102,108-113,158,181-184H,16-20,25-32,37-42,49-63,65-66,68-70,140-141H2,1-15H3,(H2,142,185)(H2,143,186)(H2,144,187)(H2,145,191)(H,159,188)(H,160,201)(H,161,206)(H,162,205)(H,163,192)(H,164,207)(H,165,212)(H,166,208)(H,167,209)(H,168,193)(H,169,194)(H,170,195)(H,171,197)(H,172,196)(H,173,202)(H,174,210)(H,175,198)(H,176,199)(H,177,200)(H,178,203)(H,179,211)(H,180,204)(H,189,190)(H4,146,147,154)(H4,148,149,155)(H4,150,151,156)(H4,152,153,157)/t73-,74-,75-,76-,77-,78+,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,108-,109-,110-,111-,112-,113-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 320 | n/a | n/a | n/a | n/a | n/a | n/a |
Department of Medicinal Chemistry and Department of Drug Delivery and Molecular Biopharmaceutics, Tokyo University of Pharmacy and Life Sciences, Hachioji, Tokyo 192-0392, Japan.
Curated by ChEMBL
| Assay Description
Inhibition of recombinant myostatin (unknown origin) expressed in HEK293 cells after 4 hrs by dual-luciferase reporter gene assay |
ACS Med Chem Lett 8: 751-756 (2017)
Article DOI: 10.1021/acsmedchemlett.7b00168
BindingDB Entry DOI: 10.7270/Q2QC05ZJ |
More data for this
Ligand-Target Pair | |
Growth/differentiation factor 8
(Homo sapiens (Human)) | BDBM50206029
(CHEMBL3892004)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)COc1ccc2ccccc2c1)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(N)=O |r| Show InChI InChI=1S/C131H220N40O33/c1-17-69(11)101(123(199)156-82(34-24-26-52-133)114(190)168-102(70(12)18-2)124(200)158-87(46-49-97(135)177)116(192)170-104(72(14)20-4)126(202)164-91(59-68(9)10)118(194)165-94(63-172)121(197)153-81(33-23-25-51-132)111(187)161-90(58-67(7)8)117(193)152-83(36-28-54-147-129(140)141)110(186)160-89(106(137)182)57-66(5)6)167-107(183)73(15)150-108(184)88(47-50-100(180)181)159-125(201)103(71(13)19-3)169-115(191)85(38-30-56-149-131(144)145)154-122(198)95(64-173)166-119(195)92(60-75-39-42-78(175)43-40-75)162-112(188)84(37-29-55-148-130(142)143)157-127(203)105(74(16)174)171-120(196)93(62-98(136)178)163-113(189)86(45-48-96(134)176)155-109(185)80(35-27-53-146-128(138)139)151-99(179)65-204-79-44-41-76-31-21-22-32-77(76)61-79/h21-22,31-32,39-44,61,66-74,80-95,101-105,172-175H,17-20,23-30,33-38,45-60,62-65,132-133H2,1-16H3,(H2,134,176)(H2,135,177)(H2,136,178)(H2,137,182)(H,150,184)(H,151,179)(H,152,193)(H,153,197)(H,154,198)(H,155,185)(H,156,199)(H,157,203)(H,158,200)(H,159,201)(H,160,186)(H,161,187)(H,162,188)(H,163,189)(H,164,202)(H,165,194)(H,166,195)(H,167,183)(H,168,190)(H,169,191)(H,170,192)(H,171,196)(H,180,181)(H4,138,139,146)(H4,140,141,147)(H4,142,143,148)(H4,144,145,149)/t69-,70-,71-,72-,73-,74+,80-,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,101-,102-,103-,104-,105-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.19E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Department of Medicinal Chemistry and Department of Drug Delivery and Molecular Biopharmaceutics, Tokyo University of Pharmacy and Life Sciences, Hachioji, Tokyo 192-0392, Japan.
Curated by ChEMBL
| Assay Description
Inhibition of recombinant myostatin (unknown origin) expressed in HEK293 cells after 4 hrs by dual-luciferase reporter gene assay |
ACS Med Chem Lett 8: 751-756 (2017)
Article DOI: 10.1021/acsmedchemlett.7b00168
BindingDB Entry DOI: 10.7270/Q2QC05ZJ |
More data for this
Ligand-Target Pair | |
Tubulin beta chain
(Sus scrofa) | BDBM50030766
(CHEMBL3342339)Show SMILES O=C(c1ccccc1)c1cccc(\C=c2/[nH]c(=O)\c(=C\c3ccccn3)[nH]c2=O)c1 Show InChI InChI=1S/C24H17N3O3/c28-22(17-8-2-1-3-9-17)18-10-6-7-16(13-18)14-20-23(29)27-21(24(30)26-20)15-19-11-4-5-12-25-19/h1-15H,(H,26,30)(H,27,29)/b20-14-,21-15- | PDB
UniProtKB/SwissProt
B.MOAD
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| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tokyo University of Pharmacy and Life Sciences
Curated by ChEMBL
| Assay Description
Inhibition of porcine tubulin polymerization by spectrophotometry |
ACS Med Chem Lett 5: 1094-8 (2014)
Article DOI: 10.1021/ml5001883
BindingDB Entry DOI: 10.7270/Q2R49SCP |
More data for this
Ligand-Target Pair | |
Tubulin beta chain
(Sus scrofa) | BDBM50030765
(NPI-2358 | Plinabulin)Show SMILES CC(C)(C)c1[nH]cnc1\C=c1/[nH]c(=O)\c(=C\c2ccccc2)[nH]c1=O Show InChI InChI=1S/C19H20N4O2/c1-19(2,3)16-13(20-11-21-16)10-15-18(25)22-14(17(24)23-15)9-12-7-5-4-6-8-12/h4-11H,1-3H3,(H,20,21)(H,22,25)(H,23,24)/b14-9-,15-10- | PDB
UniProtKB/SwissProt
B.MOAD
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| Purchase
MCE
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | 1.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tokyo University of Pharmacy and Life Sciences
Curated by ChEMBL
| Assay Description
Inhibition of porcine tubulin polymerization by spectrophotometry |
ACS Med Chem Lett 5: 1094-8 (2014)
Article DOI: 10.1021/ml5001883
BindingDB Entry DOI: 10.7270/Q2R49SCP |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Growth/differentiation factor 8
(Homo sapiens (Human)) | BDBM50071380
(CHEMBL3410232)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(N)=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.56E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Department of Medicinal Chemistry and Department of Drug Delivery and Molecular Biopharmaceutics, Tokyo University of Pharmacy and Life Sciences, Hachioji, Tokyo 192-0392, Japan.
Curated by ChEMBL
| Assay Description
Inhibition of recombinant myostatin (unknown origin) expressed in HEK293 cells after 4 hrs by dual-luciferase reporter gene assay |
ACS Med Chem Lett 8: 751-756 (2017)
Article DOI: 10.1021/acsmedchemlett.7b00168
BindingDB Entry DOI: 10.7270/Q2QC05ZJ |
More data for this
Ligand-Target Pair | |
Tubulin beta chain
(Sus scrofa) | BDBM50030766
(CHEMBL3342339)Show SMILES O=C(c1ccccc1)c1cccc(\C=c2/[nH]c(=O)\c(=C\c3ccccn3)[nH]c2=O)c1 Show InChI InChI=1S/C24H17N3O3/c28-22(17-8-2-1-3-9-17)18-10-6-7-16(13-18)14-20-23(29)27-21(24(30)26-20)15-19-11-4-5-12-25-19/h1-15H,(H,26,30)(H,27,29)/b20-14-,21-15- | PDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/a | n/a |
Tokyo University of Pharmacy and Life Sciences
Curated by ChEMBL
| Assay Description
Binding affinity to porcine tubulin incubated for 1 hr by spectrofluorometry |
ACS Med Chem Lett 5: 1094-8 (2014)
Article DOI: 10.1021/ml5001883
BindingDB Entry DOI: 10.7270/Q2R49SCP |
More data for this
Ligand-Target Pair | |
Tubulin alpha-1A/beta chain
(Sus scrofa (Pig)) | BDBM50030765
(NPI-2358 | Plinabulin)Show SMILES CC(C)(C)c1[nH]cnc1\C=c1/[nH]c(=O)\c(=C\c2ccccc2)[nH]c1=O Show InChI InChI=1S/C19H20N4O2/c1-19(2,3)16-13(20-11-21-16)10-15-18(25)22-14(17(24)23-15)9-12-7-5-4-6-8-12/h4-11H,1-3H3,(H,20,21)(H,22,25)(H,23,24)/b14-9-,15-10- | PDB
UniProtKB/SwissProt
B.MOAD
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| Purchase
MCE
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a |
Tokyo University of Pharmacy and Life Sciences
Curated by ChEMBL
| Assay Description
Binding affinity to porcine tubulin incubated for 1 hr by spectrofluorometry |
ACS Med Chem Lett 5: 1094-8 (2014)
Article DOI: 10.1021/ml5001883
BindingDB Entry DOI: 10.7270/Q2R49SCP |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
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