Found 2 hits for monomerid = 50455166 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 |
|---|
cAMP-dependent protein kinase type II-beta regulatory subunit
(Homo sapiens (Human)) | BDBM50455166
(CHEMBL4203735)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@]1(C)CCC\C=C\CCC[C@](C)(NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)COCCOCCOCCN)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N1)C(=O)N[C@@H](CCCCN)C(O)=O |r,t:18| Show InChI InChI=1S/C102H181N23O23/c1-62(2)55-76(119-89(133)73(39-25-32-46-105)114-87(131)71(37-23-30-44-103)112-82(127)61-148-54-53-147-52-51-146-50-49-108)90(134)109-67(11)84(128)113-72(38-24-31-45-104)88(132)121-80(59-70-35-21-20-22-36-70)93(137)120-79(58-65(7)8)94(138)123-83(66(9)10)97(141)122-81(60-126)96(140)125-102(15)43-29-19-17-16-18-28-42-101(14,99(144)110-69(13)86(130)118-78(57-64(5)6)92(136)116-75(98(142)143)41-27-34-48-107)124-95(139)74(40-26-33-47-106)115-91(135)77(56-63(3)4)117-85(129)68(12)111-100(102)145/h16-17,20-22,35-36,62-69,71-81,83,126H,18-19,23-34,37-61,103-108H2,1-15H3,(H,109,134)(H,110,144)(H,111,145)(H,112,127)(H,113,128)(H,114,131)(H,115,135)(H,116,136)(H,117,129)(H,118,130)(H,119,133)(H,120,137)(H,121,132)(H,122,141)(H,123,138)(H,124,139)(H,125,140)(H,142,143)/b17-16+/t67-,68-,69-,71-,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,83-,101-,102-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | 75 | n/a | n/a | n/a | n/a | n/a |
University of Georgia
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human full length PKA-R2beta expressed in Escherichia coli BL21 DE3-RIL cells assessed as reduction in interaction wi... |
Bioorg Med Chem 26: 1174-1178 (2018)
Article DOI: 10.1016/j.bmc.2018.02.001
BindingDB Entry DOI: 10.7270/Q2F47RQ6 |
More data for this
Ligand-Target Pair | |
cAMP-dependent protein kinase type II-alpha regulatory subunit
(Homo sapiens) | BDBM50455166
(CHEMBL4203735)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@]1(C)CCC\C=C\CCC[C@](C)(NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)COCCOCCOCCN)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N1)C(=O)N[C@@H](CCCCN)C(O)=O |r,t:18| Show InChI InChI=1S/C102H181N23O23/c1-62(2)55-76(119-89(133)73(39-25-32-46-105)114-87(131)71(37-23-30-44-103)112-82(127)61-148-54-53-147-52-51-146-50-49-108)90(134)109-67(11)84(128)113-72(38-24-31-45-104)88(132)121-80(59-70-35-21-20-22-36-70)93(137)120-79(58-65(7)8)94(138)123-83(66(9)10)97(141)122-81(60-126)96(140)125-102(15)43-29-19-17-16-18-28-42-101(14,99(144)110-69(13)86(130)118-78(57-64(5)6)92(136)116-75(98(142)143)41-27-34-48-107)124-95(139)74(40-26-33-47-106)115-91(135)77(56-63(3)4)117-85(129)68(12)111-100(102)145/h16-17,20-22,35-36,62-69,71-81,83,126H,18-19,23-34,37-61,103-108H2,1-15H3,(H,109,134)(H,110,144)(H,111,145)(H,112,127)(H,113,128)(H,114,131)(H,115,135)(H,116,136)(H,117,129)(H,118,130)(H,119,133)(H,120,137)(H,121,132)(H,122,141)(H,123,138)(H,124,139)(H,125,140)(H,142,143)/b17-16+/t67-,68-,69-,71-,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,83-,101-,102-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | 35 | n/a | n/a | n/a | n/a | n/a |
University of Georgia
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human full length PKA-R2alpha expressed in Escherichia coli BL21 DE3-RIL cells assessed as reduction in interaction w... |
Bioorg Med Chem 26: 1174-1178 (2018)
Article DOI: 10.1016/j.bmc.2018.02.001
BindingDB Entry DOI: 10.7270/Q2F47RQ6 |
More data for this
Ligand-Target Pair | |
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