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Report error Found 19 Enz. Inhib. hit(s) for PDB: 2ESM

Rho-associated protein kinase 1(Human)
Bioaxone Biosciences

US Patent

BDBM14027(AT877 | CHEMBL38380 | 5-(1,4-diazepan-1-ylsulfonyl...)

Kd: 50nMAssay Description:Compounds were tested using an 11-point curve with 3-fold serial dilutions. IC50 determinations were made using an ATP concentration of 10 uM. The hi...More data for this Ligand-Target Pair

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Date in BDB:
4/24/2022
Entry Details
US Patent
PDB

3D Structure (crystal)

Rho-associated protein kinase 1/2(Human)
Kirin Brewery

Curated by ChEMBL

BDBM14027(AT877 | CHEMBL38380 | 5-(1,4-diazepan-1-ylsulfonyl...)

IC50: 180nMAssay Description:Inhibition of Rho kinaseMore data for this Ligand-Target Pair

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Date in BDB:
12/10/2012
Entry Details Article
PubMed PDB

3D Structure (crystal)

Rho-associated protein kinase 1/2(Human)
Kirin Brewery

Curated by ChEMBL

BDBM14027(AT877 | CHEMBL38380 | 5-(1,4-diazepan-1-ylsulfonyl...)

IC50: 180nMAssay Description:Inhibition of Rho kinaseMore data for this Ligand-Target Pair

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Date in BDB:
11/10/2009
Entry Details Article
PubMed PDB

3D Structure (crystal)

Rho-associated protein kinase 1(Human)
Bioaxone Biosciences

US Patent

BDBM14027(AT877 | CHEMBL38380 | 5-(1,4-diazepan-1-ylsulfonyl...)

IC50: 260nMAssay Description:Inhibition of ROCK1 (unknown origin)More data for this Ligand-Target Pair

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Date in BDB:
6/21/2017
Entry Details Article
PubMed PDB

3D Structure (crystal)

Rho-associated protein kinase 1(Human)
Bioaxone Biosciences

US Patent

BDBM14027(AT877 | CHEMBL38380 | 5-(1,4-diazepan-1-ylsulfonyl...)

IC50: 260nMAssay Description:Inhibition of ROCK1 (unknown origin)More data for this Ligand-Target Pair

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Date in BDB:
3/21/2022
Entry Details Article
PubMed PDB

3D Structure (crystal)

Rho-associated protein kinase 1(Human)
Bioaxone Biosciences

US Patent

BDBM14027(AT877 | CHEMBL38380 | 5-(1,4-diazepan-1-ylsulfonyl...)

IC50: 260nMAssay Description:Inhibition of ROCK1 (unknown origin)More data for this Ligand-Target Pair

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Date in BDB:
9/2/2020
Entry Details Article
PubMed PDB

3D Structure (crystal)

Rho-associated protein kinase 1(Human)
Bioaxone Biosciences

US Patent

BDBM14027(AT877 | CHEMBL38380 | 5-(1,4-diazepan-1-ylsulfonyl...)

IC50: 300nMAssay Description:Inhibition of human recombinant N-terminal his-tagged ROCK1 (3-543) expressed in baculovirus infected Sf9 cells using Biotin-Ahx-AKRRLSSLRA-CONH2 sub...More data for this Ligand-Target Pair

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Date in BDB:
7/23/2012
Entry Details Article
PubMed PDB

3D Structure (crystal)

Rho-associated protein kinase 1(Human)
Bioaxone Biosciences

US Patent

BDBM14027(AT877 | CHEMBL38380 | 5-(1,4-diazepan-1-ylsulfonyl...)

IC50: 367nMAssay Description:Compounds as a powder were dissolved in dimethyl sulfoxide to make a 10 mM stock. Compounds were tested in 10-dose IC50 triplicate mode with a 3-fold...More data for this Ligand-Target Pair

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Date in BDB:
11/7/2024
Entry Details
US Patent
PDB

3D Structure (crystal)

Rho-associated protein kinase 1(Human)
Bioaxone Biosciences

US Patent

BDBM14027(AT877 | CHEMBL38380 | 5-(1,4-diazepan-1-ylsulfonyl...)

IC50: 660nMAssay Description:Inhibition of ROCK1More data for this Ligand-Target Pair

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Date in BDB:
11/20/2010
Entry Details Article
PubMed PDB

3D Structure (crystal)

Rho-associated protein kinase 1(Human)
Bioaxone Biosciences

US Patent

BDBM14027(AT877 | CHEMBL38380 | 5-(1,4-diazepan-1-ylsulfonyl...)

IC50: 940nMAssay Description:Inhibition of ROCK1 (unknown origin)More data for this Ligand-Target Pair

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Date in BDB:
3/21/2022
Entry Details Article
PubMed PDB

3D Structure (crystal)

Rho-associated protein kinase 1(Rat)
Bioaxone Biosciences

US Patent

BDBM14027(AT877 | CHEMBL38380 | 5-(1,4-diazepan-1-ylsulfonyl...)

IC50: 2.10E+3nMT: 2°CAssay Description:The inhibitor potency of BA-1049 (racemic mixture) and Fasudil (Calbiochem) were compared by fluorescent polarization assays performed using a Biomek...More data for this Ligand-Target Pair

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Date in BDB:
3/10/2018
Entry Details
US Patent
PDB

3D Structure (crystal)

Rho-associated protein kinase 1(Human)
Bioaxone Biosciences

US Patent

BDBM14027(AT877 | CHEMBL38380 | 5-(1,4-diazepan-1-ylsulfonyl...)

IC50: 3.16E+3nMAssay Description:Inhibition of ROCK-1 by Immobilized metal ion affinity-based fluorescence polarization assayMore data for this Ligand-Target Pair

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Date in BDB:
5/22/2013
Entry Details Article
PubMed PDB

3D Structure (crystal)

Rho-associated protein kinase 1(Human)
Bioaxone Biosciences

US Patent

BDBM14027(AT877 | CHEMBL38380 | 5-(1,4-diazepan-1-ylsulfonyl...)

IC50: 4.30E+3nMAssay Description:Inhibition of human ROCK1 by homogenous luciferase assayMore data for this Ligand-Target Pair

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Date in BDB:
12/28/2012
Entry Details Article
PubMed PDB

3D Structure (crystal)

Rho-associated protein kinase 1(Human)
Bioaxone Biosciences

US Patent

BDBM14027(AT877 | CHEMBL38380 | 5-(1,4-diazepan-1-ylsulfonyl...)

IC50: 4.30E+3nMAssay Description:Inhibition of human ROCK1 by homogenous luciferase assayMore data for this Ligand-Target Pair

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Date in BDB:
12/28/2012
Entry Details Article
PubMed PDB

3D Structure (crystal)

Rho-associated protein kinase 1(Human)
Bioaxone Biosciences

US Patent

BDBM14027(AT877 | CHEMBL38380 | 5-(1,4-diazepan-1-ylsulfonyl...)

Ki: 100nMAssay Description:Inhibition of ROCK-1More data for this Ligand-Target Pair

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Date in BDB:
5/22/2013
Entry Details Article
PubMed PDB

3D Structure (crystal)

Rho-associated protein kinase 1/2(Human)
Kirin Brewery

Curated by ChEMBL

BDBM14027(AT877 | CHEMBL38380 | 5-(1,4-diazepan-1-ylsulfonyl...)

Ki: 330nMAssay Description:Inhibition of ROCK (unknown origin)More data for this Ligand-Target Pair

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Date in BDB:
2/21/2021
Entry Details Article
PubMed PDB

3D Structure (crystal)

Rho-associated protein kinase 1(Human)
Bioaxone Biosciences

US Patent

BDBM14027(AT877 | CHEMBL38380 | 5-(1,4-diazepan-1-ylsulfonyl...)

Ki: 330nMAssay Description:Binding affinity to human ROCK1 assessed as inhibition constantMore data for this Ligand-Target Pair

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Date in BDB:
4/18/2024
Entry Details
PubMed PDB

3D Structure (crystal)

Rho-associated protein kinase 1(Human)
Bioaxone Biosciences

US Patent

BDBM14027(AT877 | CHEMBL38380 | 5-(1,4-diazepan-1-ylsulfonyl...)

Ki: 530nM ΔG°: -36.4kJ/molepH: 7.6 T: 2°CAssay Description:The enzyme activity was assayed by using an ATP regenerative NADH consuming system. The reaction was started with adding ATP to the mixture containin...More data for this Ligand-Target Pair

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Date in BDB:
2/27/2007
Entry Details Article
PubMed PDB

3D Structure (crystal)

Rho-associated protein kinase 1(Human)
Bioaxone Biosciences

US Patent

BDBM14027(AT877 | CHEMBL38380 | 5-(1,4-diazepan-1-ylsulfonyl...)

Ki: 530nMAssay Description:Inhibition of human leukocytic ROCK1 expressed in insect cells using KKRNRTLSV as substrate after 10 mins by pyruvate kinase/lactate dehydrogenase co...More data for this Ligand-Target Pair

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Date in BDB:
10/21/2016
Entry Details Article
PubMed PDB

3D Structure (crystal)

Filter my 19 hits

Targets 2▿
- Rho-associated protein kinase 1 16
- Rho-associated protein kinase 1/2 3
Publications 17▿
- J Med Chem 53: 759-77 (2010) 2
- Bioorg Med Chem Lett 21: 97-101 (2010) 2
- J Med Chem 64: 9677-9710 (2021) 1
- Bioorg Med Chem Lett 30: 127474 (2020) 1
- Bioorg Med Chem 15: 350-64 (2006) 1
- Eur J Med Chem 180: 449-456 (2019) 1
- J Med Chem 63: 10533-10593 (2020) 1
- Bioorg Med Chem 15: 1022-33 (2006) 1
- J Med Chem 59: 788-809 (2016) 1
- J Biol Chem 281: 260-8 (2006) 1
- Medchemcomm 3: 699-709 (2012) 1
- US Patent US20240246972 (2024) 1
- US Patent US11198680 (2021) 1
- Bioorg Med Chem Lett 20: 3235-9 (2010) 1
- J Pharmacol Exp Ther 320: 89-98 (2006) 1
- US Patent US9687483 (2017) 1
- J Med Chem 58: 5028-37 (2015) 1
Institutions 13▿
- Boehringer Ingelheim Pharmaceuticals 3
- Vertex Pharmaceuticals 2
- Kirin Brewery 2
- Bioaxone Biosciences 2
- Msd 2
- Lodz University of Technology 1
- Glaxosmithkline 1
- Bristol Myers Squibb 1
- Purdue University 1
- Taipei Medical University 1
- Moffitt Cancer Center 1
- Avicenna Biosciences, Inc. 1
- Georgia Institute of Technology 1
Affinity: 50 to 4.3E+3 nM▿
- Ki 5
- IC50 13
- Kd 1
- Affinity ≤ nM
Xtal structures: 1
Docked structures: 0
Catalog Cmpds: 1