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Target
Tyrosine-protein kinase receptor
Ligand
BDBM144281
Substrate
n/a
Meas. Tech.
Inhibition Assay
IC50
0.99±n/a nM
Citation
 Shimada, I; Kurosawa, K; Matsuya, T; Iikubo, K; Kondoh, Y; Kamikawa, A; Tomiyama, H; Iwai, Y Diamino heterocyclic carboxamide compound US Patent  US8969336 Publication Date 3/3/2015 
Target
Name:
Tyrosine-protein kinase receptor
Synonyms:
EML4 ALK Fusion Protein
Type:
Protein
Mol. Mass.:
87656.33
Organism:
Homo sapiens (Human)
Description:
A9YLN7
Residue:
796
Sequence:
MDGFAGSLDDSISAASTSDVQDRLSALESRVQQQEDEITVLKAALADVLRRLAISEDHVASVKKSVSSKGQPSPRAVIPMSCITNGSGANRKPSHTSAVSIAGKETLSSAAKSGTEKKKEKPQGQREKKEESHSNDQSPQIRASPSPQPSSQPLQIHRQTPESKNATPTKSIKRPSPAEKSHNSWENSDDSRNKLSKIPSTPKLIPKVTKTADKHKDVIINQAKMSTREKNSQVYRRKHQELQAMQMELQSPEYKLSKLRTSTIMTDYNPNYCFAGKTSSISDLKEVPRKNITLIRGLGHGAFGEVYEGQVSGMPNDPSPLQVAVKTLPEVCSEQDELDFLMEALIISKFNHQNIVRCIGVSLQSLPRFILLELMAGGDLKSFLRETRPRPSQPSSLAMLDLLHVARDIACGCQYLEENHFIHRDIAARNCLLTCPGPGRVAKIGDFGMARDIYRASYYRKGGCAMLPVKWMPPEAFMEGIFTSKTDTWSFGVLLWEIFSLGYMPYPSKSNQEVLEFVTSGGRMDPPKNCPGPVYRIMTQCWQHQPEDRPNFAIILERIEYCTQDPDVINTALPIEYGPLVEEEEKVPVRPKDPEGVPPLLVSQQAKREEERSPAAPPPLPTTSSGKAAKKPTAAEISVRVPRGPAVEGGHVNMAFSQSNPPSELHKVHGSRNKPTSLWNPTYGSWFTEKPTKKNNPIAKKEPHDRGNLGLEGSCTVPPNVATGRLPGASLLLEPSSLTANMKEVPLFRLRHFPCGNVNYGYQQQGLPLEAATAPGAGHYEDTILKSKNSMNQPGP
  
Inhibitor
Name:
BDBM144281
Synonyms:
US8969336, 110
Type:
Small organic molecule
Emp. Form.:
C21H29N5O4S
Mol. Mass.:
447.551
SMILES:
CCc1nc(C(N)=O)c(Nc2cccc(c2)S(C)(=O)=O)nc1N[C@H]1CC[C@](C)(O)CC1 |r,wU:26.29,wD:23.24,26.28,(-2.44,4.31,;-2.44,2.77,;-1.1,2,;.23,2.77,;1.56,2,;2.9,2.77,;2.9,4.31,;4.23,2,;1.56,.46,;2.9,-.31,;2.9,-1.85,;1.56,-2.62,;1.56,-4.16,;2.9,-4.93,;4.23,-4.16,;4.23,-2.62,;5.56,-4.93,;6.33,-3.59,;6.9,-5.7,;4.79,-6.26,;.23,-.31,;-1.1,.46,;-2.44,-.31,;-3.77,.46,;-3.77,2,;-5.1,2.77,;-6.44,2,;-7.98,2.06,;-7.25,3.31,;-6.44,.46,;-5.1,-.31,)|
Structure:
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