Found 2 hits Enz. Inhib. hit(s) with Target = 'IgG receptor FcRn large subunit p51' and Ligand = 'BDBM50270964' 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 |
|---|
IgG receptor FcRn large subunit p51
(Homo sapiens (Human)) | BDBM50270964
((2R)-2-{[(2S)-1-[(2S)-2-[(2S)-2-{[(3S,6R,8aR)-6-[(...)Show SMILES CC(C)C[C@H](NC(=O)[C@H]1CS[C@@H]2CC[C@@H](NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](Cc3cnc[nH]3)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@@H](N)CCCN=C(N)N)C(C)(C)S)[C@@H](C)O)C(=O)N12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(O)=O |r,wU:4.4,11.84,62.65,18.26,wD:43.45,75.79,103.109,29.37,84.88,51.61,8.7,14.14,47.49,99.106,(26.5,-35.7,;25.43,-36.79,;25.84,-38.27,;23.94,-36.41,;22.86,-37.5,;21.39,-37.28,;20.89,-35.83,;19.38,-35.53,;21.9,-34.67,;23.43,-34.81,;24.04,-33.4,;22.88,-32.39,;22.86,-30.86,;21.53,-30.11,;20.21,-30.89,;18.87,-30.14,;17.51,-30.87,;17.52,-32.42,;16.22,-30,;16.22,-28.45,;17.56,-27.68,;18.88,-28.45,;20.22,-27.69,;20.22,-26.15,;18.88,-25.38,;17.55,-26.15,;15,-30.89,;13.64,-30.17,;13.65,-28.62,;12.37,-31.03,;12.37,-32.58,;13.71,-33.35,;15.17,-32.86,;16.08,-34.1,;15.19,-35.35,;13.72,-34.89,;10.98,-30.14,;9.62,-30.87,;9.63,-32.41,;8.34,-30,;7.13,-30.89,;5.77,-30.17,;5.78,-28.62,;4.5,-31.03,;3.28,-30.14,;1.95,-30.92,;1.96,-32.47,;.61,-30.15,;-.72,-30.94,;-2.09,-30.22,;-2.08,-28.67,;-3.37,-31.08,;-3.37,-32.64,;-2.03,-33.42,;-.69,-32.65,;.65,-33.42,;.65,-34.97,;-.69,-35.74,;-2.03,-34.97,;-4.58,-30.2,;-5.95,-30.92,;-5.94,-32.47,;-7.24,-30.05,;-8.46,-30.94,;-7.24,-28.49,;-5.9,-27.72,;-5.89,-26.17,;-4.56,-25.45,;-4.52,-23.9,;-3.17,-23.17,;-5.84,-23.1,;.59,-28.61,;-.95,-28.62,;.59,-27.06,;2.14,-28.6,;4.5,-32.58,;3.16,-33.35,;5.83,-33.35,;20.22,-32.43,;18.9,-33.22,;21.56,-33.17,;23.17,-39,;22.09,-40.1,;24.64,-39.44,;24.88,-40.92,;23.8,-42.02,;23.79,-43.55,;25.13,-44.32,;25.12,-45.86,;23.79,-46.63,;23.78,-48.17,;22.45,-45.85,;22.46,-44.31,;26.39,-41.19,;27.47,-40.1,;26.85,-42.66,;25.94,-43.89,;26.83,-45.15,;28.3,-44.69,;28.31,-43.15,;29.56,-42.25,;29.41,-40.72,;30.97,-42.89,;31.22,-44.36,;30.13,-45.47,;30.54,-46.94,;32.72,-44.65,;33.18,-46.12,;33.81,-43.56,)| Show InChI InChI=1S/C72H100N18O16S3/c1-38(2)28-47(60(95)85-51(31-42-20-22-44(92)23-21-42)68(103)89-27-13-19-53(89)64(99)86-52(35-107)70(105)106)84-65(100)54-36-109-56-25-24-46(69(104)90(54)56)81-61(96)48(29-40-14-8-6-9-15-40)83-62(97)50(32-43-33-76-37-79-43)80-55(93)34-78-66(101)57(39(3)91)87-67(102)58(72(4,5)108)88-63(98)49(30-41-16-10-7-11-17-41)82-59(94)45(73)18-12-26-77-71(74)75/h6-11,14-17,20-23,33,37-39,45-54,56-58,91-92,107-108H,12-13,18-19,24-32,34-36,73H2,1-5H3,(H,76,79)(H,78,101)(H,80,93)(H,81,96)(H,82,94)(H,83,97)(H,84,100)(H,85,95)(H,86,99)(H,87,102)(H,88,98)(H,105,106)(H4,74,75,77)/t39-,45+,46-,47+,48+,49+,50+,51+,52+,53+,54-,56-,57+,58+/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.20E+3 | n/a | n/a | n/a | n/a | n/a | n/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 | |
IgG receptor FcRn large subunit p51
(Homo sapiens (Human)) | BDBM50270964
((2R)-2-{[(2S)-1-[(2S)-2-[(2S)-2-{[(3S,6R,8aR)-6-[(...)Show SMILES CC(C)C[C@H](NC(=O)[C@H]1CS[C@@H]2CC[C@@H](NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](Cc3cnc[nH]3)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@@H](N)CCCN=C(N)N)C(C)(C)S)[C@@H](C)O)C(=O)N12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(O)=O |r,wU:4.4,11.84,62.65,18.26,wD:43.45,75.79,103.109,29.37,84.88,51.61,8.7,14.14,47.49,99.106,(26.5,-35.7,;25.43,-36.79,;25.84,-38.27,;23.94,-36.41,;22.86,-37.5,;21.39,-37.28,;20.89,-35.83,;19.38,-35.53,;21.9,-34.67,;23.43,-34.81,;24.04,-33.4,;22.88,-32.39,;22.86,-30.86,;21.53,-30.11,;20.21,-30.89,;18.87,-30.14,;17.51,-30.87,;17.52,-32.42,;16.22,-30,;16.22,-28.45,;17.56,-27.68,;18.88,-28.45,;20.22,-27.69,;20.22,-26.15,;18.88,-25.38,;17.55,-26.15,;15,-30.89,;13.64,-30.17,;13.65,-28.62,;12.37,-31.03,;12.37,-32.58,;13.71,-33.35,;15.17,-32.86,;16.08,-34.1,;15.19,-35.35,;13.72,-34.89,;10.98,-30.14,;9.62,-30.87,;9.63,-32.41,;8.34,-30,;7.13,-30.89,;5.77,-30.17,;5.78,-28.62,;4.5,-31.03,;3.28,-30.14,;1.95,-30.92,;1.96,-32.47,;.61,-30.15,;-.72,-30.94,;-2.09,-30.22,;-2.08,-28.67,;-3.37,-31.08,;-3.37,-32.64,;-2.03,-33.42,;-.69,-32.65,;.65,-33.42,;.65,-34.97,;-.69,-35.74,;-2.03,-34.97,;-4.58,-30.2,;-5.95,-30.92,;-5.94,-32.47,;-7.24,-30.05,;-8.46,-30.94,;-7.24,-28.49,;-5.9,-27.72,;-5.89,-26.17,;-4.56,-25.45,;-4.52,-23.9,;-3.17,-23.17,;-5.84,-23.1,;.59,-28.61,;-.95,-28.62,;.59,-27.06,;2.14,-28.6,;4.5,-32.58,;3.16,-33.35,;5.83,-33.35,;20.22,-32.43,;18.9,-33.22,;21.56,-33.17,;23.17,-39,;22.09,-40.1,;24.64,-39.44,;24.88,-40.92,;23.8,-42.02,;23.79,-43.55,;25.13,-44.32,;25.12,-45.86,;23.79,-46.63,;23.78,-48.17,;22.45,-45.85,;22.46,-44.31,;26.39,-41.19,;27.47,-40.1,;26.85,-42.66,;25.94,-43.89,;26.83,-45.15,;28.3,-44.69,;28.31,-43.15,;29.56,-42.25,;29.41,-40.72,;30.97,-42.89,;31.22,-44.36,;30.13,-45.47,;30.54,-46.94,;32.72,-44.65,;33.18,-46.12,;33.81,-43.56,)| Show InChI InChI=1S/C72H100N18O16S3/c1-38(2)28-47(60(95)85-51(31-42-20-22-44(92)23-21-42)68(103)89-27-13-19-53(89)64(99)86-52(35-107)70(105)106)84-65(100)54-36-109-56-25-24-46(69(104)90(54)56)81-61(96)48(29-40-14-8-6-9-15-40)83-62(97)50(32-43-33-76-37-79-43)80-55(93)34-78-66(101)57(39(3)91)87-67(102)58(72(4,5)108)88-63(98)49(30-41-16-10-7-11-17-41)82-59(94)45(73)18-12-26-77-71(74)75/h6-11,14-17,20-23,33,37-39,45-54,56-58,91-92,107-108H,12-13,18-19,24-32,34-36,73H2,1-5H3,(H,76,79)(H,78,101)(H,80,93)(H,81,96)(H,82,94)(H,83,97)(H,84,100)(H,85,95)(H,86,99)(H,87,102)(H,88,98)(H,105,106)(H4,74,75,77)/t39-,45+,46-,47+,48+,49+,50+,51+,52+,53+,54-,56-,57+,58+/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 320 | n/a | n/a | n/a | 6.0 | n/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 | |
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