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Target
Serine/threonine-protein kinase receptor R3
Ligand
BDBM160279
Substrate
n/a
Meas. Tech.
Flashplate Assay
IC50
2±n/a nM
Citation
 Klar, J; Vöhringer, V; Telser, J; Lobell, M; Süβmeier, F; Li, VM; Böttger, M; Golz, S; Lang, D; Schlemmer, K; Schlange, T; Schall, A; Fu, W Hydroxymethylaryl-substituted pyrrolotriazines as ALK1 inhibitors US Patent  US9040691 Publication Date 5/26/2015 
Target
Name:
Serine/threonine-protein kinase receptor R3
Synonyms:
ACVL1_HUMAN | ACVRL1 | ACVRLK1 | ALK1 | Activin receptor-like kinase 1 (ALK-1) | Serine/threonine-protein kinase receptor R3 (ALK1)
Type:
Enzyme
Mol. Mass.:
56134.46
Organism:
Homo sapiens (Human)
Description:
P37023
Residue:
503
Sequence:
MTLGSPRKGLLMLLMALVTQGDPVKPSRGPLVTCTCESPHCKGPTCRGAWCTVVLVREEGRHPQEHRGCGNLHRELCRGRPTEFVNHYCCDSHLCNHNVSLVLEATQPPSEQPGTDGQLALILGPVLALLALVALGVLGLWHVRRRQEKQRGLHSELGESSLILKASEQGDSMLGDLLDSDCTTGSGSGLPFLVQRTVARQVALVECVGKGRYGEVWRGLWHGESVAVKIFSSRDEQSWFRETEIYNTVLLRHDNILGFIASDMTSRNSSTQLWLITHYHEHGSLYDFLQRQTLEPHLALRLAVSAACGLAHLHVEIFGTQGKPAIAHRDFKSRNVLVKSNLQCCIADLGLAVMHSQGSDYLDIGNNPRVGTKRYMAPEVLDEQIRTDCFESYKWTDIWAFGLVLWEIARRTIVNGIVEDYRPPFYDVVPNDPSFEDMKKVVCVDQQTPTIPNRLAADPVLSGLAQMMRECWYPNPSARLTALRIKKTLQKISNSPEKPKVIQ
  
Inhibitor
Name:
BDBM160279
Synonyms:
US9040691, 7
Type:
Small organic molecule
Emp. Form.:
C19H20F2N4O2
Mol. Mass.:
374.3845
SMILES:
Nc1ncnn2c(cc(-c3cc(F)c(CO)c(F)c3)c12)[C@H]1CC[C@H](O)CC1 |r,wU:20.22,wD:23.26,(2.62,2.54,;2.62,1,;3.95,.23,;3.95,-1.31,;2.62,-2.08,;1.28,-1.31,;-.18,-1.79,;-1.09,-.54,;-.18,.7,;-.58,2.19,;-2.07,2.59,;-2.46,4.08,;-3.95,4.47,;-1.38,5.16,;-1.77,6.65,;-.69,7.74,;.11,4.77,;1.2,5.85,;.51,3.28,;1.28,.23,;-.58,-3.28,;.51,-4.37,;.11,-5.85,;-1.38,-6.25,;-1.77,-7.74,;-2.46,-5.16,;-2.07,-3.68,)|
Structure:
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