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Target
Rho-associated protein kinase 2
Ligand
BDBM510897
Substrate
n/a
Meas. Tech.
In Vitro Assay
IC50
6800±n/a nM
Citation
 Glunz, PW; Ladziata, V; De Lucca, I; Tora, GO; Maishal, TK; Tangirala, R; Thiyagarajan, K 5-membered and bicyclic heterocyclic amides as inhibitors of rock US Patent  US11078197 Publication Date 8/3/2021 
Target
Name:
Rho-associated protein kinase 2
Synonyms:
KIAA0619 | ROCK-II | ROCK2 | ROCK2_HUMAN | Rho kinase 2 (ROCKII) | Rho-associated protein kinase 2 (ROCK-2) | Rho-associated protein kinase 2 (ROCK2) | Rho-associated protein kinase 2 (ROCKII) | Rho-associated protein kinase 2/Transforming protein RhoA | Rho-associated, coiled-coil-containing protein kinase 2 | Rho-associated, coiled-coil-containing protein kinase II | Serine/threonine-protein kinase RIO2 | p164 ROCK-2
Type:
Protein
Mol. Mass.:
160885.43
Organism:
Homo sapiens (Human)
Description:
O75116
Residue:
1388
Sequence:
MSRPPPTGKMPGAPETAPGDGAGASRQRKLEALIRDPRSPINVESLLDGLNSLVLDLDFPALRKNKNIDNFLNRYEKIVKKIRGLQMKAEDYDVVKVIGRGAFGEVQLVRHKASQKVYAMKLLSKFEMIKRSDSAFFWEERDIMAFANSPWVVQLFYAFQDDRYLYMVMEYMPGGDLVNLMSNYDVPEKWAKFYTAEVVLALDAIHSMGLIHRDVKPDNMLLDKHGHLKLADFGTCMKMDETGMVHCDTAVGTPDYISPEVLKSQGGDGFYGRECDWWSVGVFLYEMLVGDTPFYADSLVGTYSKIMDHKNSLCFPEDAEISKHAKNLICAFLTDREVRLGRNGVEEIRQHPFFKNDQWHWDNIRETAAPVVPELSSDIDSSNFDDIEDDKGDVETFPIPKAFVGNQLPFIGFTYYRENLLLSDSPSCRETDSIQSRKNEESQEIQKKLYTLEEHLSNEMQAKEELEQKCKSVNTRLEKTAKELEEEITLRKSVESALRQLEREKALLQHKNAEYQRKADHEADKKRNLENDVNSLKDQLEDLKKRNQNSQISTEKVNQLQRQLDETNALLRTESDTAARLRKTQAESSKQIQQLESNNRDLQDKNCLLETAKLKLEKEFINLQSALESERRDRTHGSEIINDLQGRICGLEEDLKNGKILLAKVELEKRQLQERFTDLEKEKSNMEIDMTYQLKVIQQSLEQEEAEHKATKARLADKNKIYESIEEAKSEAMKEMEKKLLEERTLKQKVENLLLEAEKRCSLLDCDLKQSQQKINELLKQKDVLNEDVRNLTLKIEQETQKRCLTQNDLKMQTQQVNTLKMSEKQLKQENNHLMEMKMNLEKQNAELRKERQDADGQMKELQDQLEAEQYFSTLYKTQVRELKEECEEKTKLGKELQQKKQELQDERDSLAAQLEITLTKADSEQLARSIAEEQYSDLEKEKIMKELEIKEMMARHKQELTEKDATIASLEETNRTLTSDVANLANEKEELNNKLKDVQEQLSRLKDEEISAAAIKAQFEKQLLTERTLKTQAVNKLAEIMNRKEPVKRGNDTDVRRKEKENRKLHMELKSEREKLTQQMIKYQKELNEMQAQIAEESQIRIELQMTLDSKDSDIEQLRSQLQALHIGLDSSSIGSGPGDAEADDGFPESRLEGWLSLPVRNNTKKFGWVKKYVIVSSKKILFYDSEQDKEQSNPYMVLDIDKLFHVRPVTQTDVYRADAKEIPRIFQILYANEGESKKEQEFPVEPVGEKSNYICHKGHEFIPTLYHFPTNCEACMKPLWHMFKPPPALECRRCHIKCHKDHMDKKEEIIAPCKVYYDISTAKNLLLLANSTEEQQKWVSRLVKKIPKKPPAPDPFARSSPRTSMKIQQNQSIRRPSRQLAPNKPS
  
Inhibitor
Name:
BDBM510897
Synonyms:
5-({6-[6-( 2- hydroxy-2- methylpropoxy) pyrazolo[1,5-a] pyridine-3- amido]spiro[3.3] heptan-2- yl}oxy)thieno[3,2- b]pyridine-6- carboxamide | US11078197, Example 76 | US11673886, Example 76
Type:
Small organic molecule
Emp. Form.:
C27H29N5O5S
Mol. Mass.:
535.615
SMILES:
CC(C)(O)COc1ccc2c(cnn2c1)C(=O)NC1CC2(C1)CC(C2)Oc1nc2ccsc2cc1C(N)=O |(4.52,-3.98,;5.55,-2.84,;7.06,-3.16,;5.95,-4.32,;5.08,-1.37,;3.57,-1.05,;3.09,.41,;1.59,.73,;1.11,2.2,;2.14,3.34,;1.98,4.87,;3.39,5.5,;4.42,4.35,;3.65,3.02,;4.12,1.56,;.65,5.64,;.65,7.18,;-.69,4.87,;-.69,3.33,;.4,2.24,;-.69,1.15,;-1.78,2.24,;.4,.07,;-.69,-1.02,;-1.78,.07,;-.69,-2.56,;-2.02,-3.33,;-3.35,-2.56,;-4.69,-3.33,;-6.15,-2.86,;-7.06,-4.1,;-6.15,-5.35,;-4.69,-4.87,;-3.35,-5.64,;-2.02,-4.87,;-.69,-5.64,;.65,-4.87,;-.69,-7.18,)|
Structure:
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