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BDBM50270820 (2R)-2-{[(2S)-1-[(2S)-2-[(2S)-2-(2-{2-[(2S)-2-[(2S)-2-{2-[(2S,3R)-2-[(2R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-methyl-3-sulfanylbutanamido]-3-hydroxybutanamido]acetamido}-3-(1H-imidazol-5-yl)propanamido]-3-phenylpropanamido]acetamido}acetamido)-4-methylpentanamido]-3-(4-hydroxyphenyl)propanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanoic acid::CHEMBL510716

SMILES: CC(C)C[C@H](NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)C(C)(C)S)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(O)=O

InChI Key: InChIKey=XXVCSGPXOMEPGM-CGJNYSTESA-N

Data: 1 IC50  1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50270820   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
IgG receptor FcRn large subunit p51


(Homo sapiens (Human))
BDBM50270820
PNG
((2R)-2-{[(2S)-1-[(2S)-2-[(2S)-2-(2-{2-[(2S)-2-[(2S...)
Show SMILES CC(C)C[C@H](NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)C(C)(C)S)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(O)=O |r|
Show InChI InChI=1S/C62H84N14O15S2/c1-34(2)23-42(55(84)72-45(26-38-18-20-40(78)21-19-38)60(89)76-22-12-17-47(76)57(86)73-46(32-92)61(90)91)69-49(80)30-65-48(79)29-66-54(83)43(25-37-15-10-7-11-16-37)71-56(85)44(27-39-28-64-33-68-39)70-50(81)31-67-58(87)51(35(3)77)74-59(88)52(62(4,5)93)75-53(82)41(63)24-36-13-8-6-9-14-36/h6-11,13-16,18-21,28,33-35,41-47,51-52,77-78,92-93H,12,17,22-27,29-32,63H2,1-5H3,(H,64,68)(H,65,79)(H,66,83)(H,67,87)(H,69,80)(H,70,81)(H,71,85)(H,72,84)(H,73,86)(H,74,88)(H,75,82)(H,90,91)/t35-,41+,42+,43+,44+,45+,46+,47+,51+,52-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 310n/an/an/a6.0n/a



Syntonix Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human FcRn at pH 6 by surface plasmon resonance assay


Bioorg Med Chem 16: 6394-405 (2008)


Article DOI: 10.1016/j.bmc.2008.05.004
BindingDB Entry DOI: 10.7270/Q2QV3M9C
More data for this
Ligand-Target Pair
IgG receptor FcRn large subunit p51


(Homo sapiens (Human))
BDBM50270820
PNG
((2R)-2-{[(2S)-1-[(2S)-2-[(2S)-2-(2-{2-[(2S)-2-[(2S...)
Show SMILES CC(C)C[C@H](NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)C(C)(C)S)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(O)=O |r|
Show InChI InChI=1S/C62H84N14O15S2/c1-34(2)23-42(55(84)72-45(26-38-18-20-40(78)21-19-38)60(89)76-22-12-17-47(76)57(86)73-46(32-92)61(90)91)69-49(80)30-65-48(79)29-66-54(83)43(25-37-15-10-7-11-16-37)71-56(85)44(27-39-28-64-33-68-39)70-50(81)31-67-58(87)51(35(3)77)74-59(88)52(62(4,5)93)75-53(82)41(63)24-36-13-8-6-9-14-36/h6-11,13-16,18-21,28,33-35,41-47,51-52,77-78,92-93H,12,17,22-27,29-32,63H2,1-5H3,(H,64,68)(H,65,79)(H,66,83)(H,67,87)(H,69,80)(H,70,81)(H,71,85)(H,72,84)(H,73,86)(H,74,88)(H,75,82)(H,90,91)/t35-,41+,42+,43+,44+,45+,46+,47+,51+,52-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.70E+3n/an/an/an/an/an/a



Syntonix Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human IgG binding to soluble human FcRn by ELISA


Bioorg Med Chem 16: 6394-405 (2008)


Article DOI: 10.1016/j.bmc.2008.05.004
BindingDB Entry DOI: 10.7270/Q2QV3M9C
More data for this
Ligand-Target Pair