Reaction Details Report a problem with these data
Target
Sphingosine kinase 2
Ligand
BDBM50359977
Substrate
n/a
Meas. Tech.
ChEMBL_855990 (CHEMBL2161991)
Ki
21000±n/a nM
Citation
 Knott, K; Kharel, Y; Raje, MR; Lynch, KR; Santos, WL Effect of alkyl chain length on sphingosine kinase 2 selectivity. Bioorg Med Chem Lett 22:6817-20 (2012) [PubMed]  Article 
Target
Name:
Sphingosine kinase 2
Synonyms:
SK 2 | SK2 | SPHK2 | SPHK2_HUMAN | SPK 2 | Sphingosine kinase 2 | Sphingosine kinase types 2 (SphK2)
Type:
Protein
Mol. Mass.:
69221.44
Organism:
Homo sapiens (Human)
Description:
Q9NRA0
Residue:
654
Sequence:
MNGHLEAEEQQDQRPDQELTGSWGHGPRSTLVRAKAMAPPPPPLAASTPLLHGEFGSYPARGPRFALTLTSQALHIQRLRPKPEARPRGGLVPLAEVSGCCTLRSRSPSDSAAYFCIYTYPRGRRGARRRATRTFRADGAATYEENRAEAQRWATALTCLLRGLPLPGDGEITPDLLPRPPRLLLLVNPFGGRGLAWQWCKNHVLPMISEAGLSFNLIQTERQNHARELVQGLSLSEWDGIVTVSGDGLLHEVLNGLLDRPDWEEAVKMPVGILPCGSGNALAGAVNQHGGFEPALGLDLLLNCSLLLCRGGGHPLDLLSVTLASGSRCFSFLSVAWGFVSDVDIQSERFRALGSARFTLGTVLGLATLHTYRGRLSYLPATVEPASPTPAHSLPRAKSELTLTPDPAPPMAHSPLHRSVSDLPLPLPQPALASPGSPEPLPILSLNGGGPELAGDWGGAGDAPLSPDPLLSSPPGSPKAALHSPVSEGAPVIPPSSGLPLPTPDARVGASTCGPPDHLLPPLGTPLPPDWVTLEGDFVLMLAISPSHLGADLVAAPHARFDDGLVHLCWVRSGISRAALLRLFLAMERGSHFSLGCPQLGYAAARAFRLEPLTPRGVLTVDGEQVEYGPLQAQMHPGIGTLLTGPPGCPGREP
  
Inhibitor
Name:
BDBM50359977
Synonyms:
CHEMBL1927590
Type:
Small organic molecule
Emp. Form.:
C25H44N
Mol. Mass.:
358.623
SMILES:
CCCCCCCCc1ccc(cc1)[C@H]1CC[C@@H](CC1)[N+](C)(C)CCC |r,wU:14.14,wD:17.21,(13.28,-44.88,;11.94,-45.65,;10.61,-44.88,;9.28,-45.65,;7.95,-44.88,;6.62,-45.65,;5.29,-44.88,;3.95,-45.65,;2.62,-44.88,;2.62,-43.35,;1.29,-42.58,;-.04,-43.35,;-.04,-44.88,;1.29,-45.65,;-1.37,-42.58,;-2.7,-43.35,;-4.04,-42.58,;-4.04,-41.04,;-2.7,-40.27,;-1.37,-41.04,;-5.37,-40.27,;-5.37,-38.73,;-6.7,-41.04,;-6.71,-39.49,;-6.71,-37.96,;-8.04,-37.19,)|
Structure:
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