Reaction Details Report a problem with these data
Target
Lysine-specific histone demethylase 1A
Ligand
BDBM391925
Substrate
n/a
Meas. Tech.
Biochemical Assay for LSD1 Activity (50 minutes)
IC50
67.3±n/a nM
Citation
 Albrecht, BK; Audia, JE; Cote, A; Duplessis, M; Gehling, VS; Good, AC; Harmange, J; LeBlanc, Y; Nasveschuk, CG; Taylor, AM; Vaswani, RG Therapeutic compounds and uses thereof US Patent  US10301253 Publication Date 5/28/2019 
Target
Name:
Lysine-specific histone demethylase 1A
Synonyms:
AOF2 | BRAF35-HDAC complex protein BHC110 | Flavin-containing amine oxidase domain-containing protein 2 | KDM1 | KDM1A | KDM1A_HUMAN | KIAA0601 | LSD1 | Lysine-specific demethylase 1 (LSD1) | Lysine-specific histone demethylase 1 | Lysine-specific histone demethylase 1 (LSD1)
Type:
Enzyme
Mol. Mass.:
92901.01
Organism:
Homo sapiens (Human)
Description:
O60341
Residue:
852
Sequence:
MLSGKKAAAAAAAAAAAATGTEAGPGTAGGSENGSEVAAQPAGLSGPAEVGPGAVGERTPRKKEPPRASPPGGLAEPPGSAGPQAGPTVVPGSATPMETGIAETPEGRRTSRRKRAKVEYREMDESLANLSEDEYYSEEERNAKAEKEKKLPPPPPQAPPEEENESEPEEPSGVEGAAFQSRLPHDRMTSQEAACFPDIISGPQQTQKVFLFIRNRTLQLWLDNPKIQLTFEATLQQLEAPYNSDTVLVHRVHSYLERHGLINFGIYKRIKPLPTKKTGKVIIIGSGVSGLAAARQLQSFGMDVTLLEARDRVGGRVATFRKGNYVADLGAMVVTGLGGNPMAVVSKQVNMELAKIKQKCPLYEANGQAVPKEKDEMVEQEFNRLLEATSYLSHQLDFNVLNNKPVSLGQALEVVIQLQEKHVKDEQIEHWKKIVKTQEELKELLNKMVNLKEKIKELHQQYKEASEVKPPRDITAEFLVKSKHRDLTALCKEYDELAETQGKLEEKLQELEANPPSDVYLSSRDRQILDWHFANLEFANATPLSTLSLKHWDQDDDFEFTGSHLTVRNGYSCVPVALAEGLDIKLNTAVRQVRYTASGCEVIAVNTRSTSQTFIYKCDAVLCTLPLGVLKQQPPAVQFVPPLPEWKTSAVQRMGFGNLNKVVLCFDRVFWDPSVNLFGHVGSTTASRGELFLFWNLYKAPILLALVAGEAAGIMENISDDVIVGRCLAILKGIFGSSAVPQPKETVVSRWRADPWARGSYSYVAAGSSGNDYDLMAQPITPGPSIPGAPQPIPRLFFAGEHTIRNYPATVHGALLSGLREAGRIADQFLGAMYTLPRQATPGVPAQQSPSM
  
Inhibitor
Name:
BDBM391925
Synonyms:
N1-(6''-chloro-2'',3''- dihydrospiro[cyclopropane- 1,1''-inden]-2- yl)cyclohexane-1,4- diamine | US10301253, Example 77 | US10301253, Example 78 | US10301253, Example 79 | US10301253, Example 80
Type:
Small organic molecule
Emp. Form.:
C17H23ClN2
Mol. Mass.:
290.831
SMILES:
NC1CCC(CC1)NC1CC11CCc2ccc(Cl)cc12 |(6.2,-2.18,;5.11,-1.09,;3.62,-1.49,;2.53,-.4,;2.93,1.09,;4.42,1.49,;5.51,.4,;1.84,2.18,;.36,1.78,;-1.13,2.18,;-.73,.69,;.17,-.56,;-.73,-1.8,;-2.2,-1.33,;-3.53,-2.1,;-4.87,-1.33,;-4.87,.21,;-6.2,.98,;-3.53,.98,;-2.2,.21,)|
Structure:
Search PDB for entries with ligand similarity: