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Target
Activin receptor type-1 [172-499]
Ligand
BDBM451770
Substrate
n/a
Meas. Tech.
Caliper Assay
IC50
11.0±n/a nM
Citation
 Arista, L; Babu, S; Bian, J; Cui, K; Dillon, MP; Lattmann, R; Li, J; Liao, L; Lizos, D; Ramos, R; Stiefl, NJ; Ullrich, T; Usselmann, P; Wang, X; Waykole, LM; Weiler, S; Zhang, Y; Zhou, Y; Zhu, T Aminopyridine derivatives and their use as selective ALK-2 inhibitors US Patent  US10710980 Publication Date 7/14/2020 
Target
Name:
Activin receptor type-1 [172-499]
Synonyms:
ACVR1 | ACVR1_HUMAN | ACVRLK2 | Activin receptor type-1 (ACVR1) | Activin receptor-like kinase 2 (ALK-2)(aa 172-499) | Activin receptor-like kinase 2 (ALK2)(172-499)
Type:
Enzyme Catalytic Domain
Mol. Mass.:
37139.64
Organism:
Homo sapiens (Human)
Description:
aa 172-499
Residue:
328
Sequence:
TTNVGDSTLADLLDHSCTSGSGSGLPFLVQRTVARQITLLECVGKGRYGEVWRGSWQGENVAVKIFSSRDEKSWFRETELYNTVMLRHENILGFIASDMTSRHSSTQLWLITHYHEMGSLYDYLQLTTLDTVSCLRIVLSIASGLAHLHIEIFGTQGKPAIAHRDLKSKNILVKKNGQCCIADLGLAVMHSQSTNQLDVGNNPRVGTKRYMAPEVLDETIQVDCFDSYKRVDIWAFGLVLWEVARRMVSNGIVEDYKPPFYDVVPNDPSFEDMRKVVCVDQQRPNIPNRWFSDPTLTSLAKLMKECWYQNPSARLTALRIKKTLTKID
  
Inhibitor
Name:
BDBM451770
Synonyms:
US10710980, Example 2 | US10947218, Example 2
Type:
Small organic molecule
Emp. Form.:
C26H34N4O2
Mol. Mass.:
434.5738
SMILES:
CC(C)N1C[C@H]2C[C@]2(C1)c1ccc(cc1)-c1cnc(N)c(c1)C(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:7.10,25.28,wD:5.5,28.32,(6.7,-4.95,;7.61,-3.7,;9.14,-3.86,;6.98,-2.29,;7.75,-.96,;6.72,.18,;5.48,1.09,;5.31,-.44,;5.48,-1.97,;3.98,.33,;2.65,-.44,;1.31,.33,;1.31,1.87,;2.65,2.64,;3.98,1.87,;-.02,2.64,;-.02,4.18,;-1.35,4.95,;-2.69,4.18,;-4.02,4.95,;-2.69,2.64,;-1.35,1.87,;-4.02,1.87,;-5.36,2.64,;-4.02,.33,;-5.36,-.44,;-5.22,-1.98,;-6.48,-2.86,;-7.88,-2.21,;-9.14,-3.09,;-8.01,-.68,;-6.75,.21,)|
Structure:
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