Reaction Details Report a problem with these data
Target
Lysine-specific histone demethylase 1A
Ligand
BDBM391911
Substrate
n/a
Meas. Tech.
Biochemical Assay for LSD1 Activity (15 minutes)
IC50
31.8±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:
BDBM391911
Synonyms:
N-(3- (aminomethyl)cyclobutyl)- 2',3'- dihydrospiro[cyclopropane- 1,1'-inden]-2-amine | US10301253, Example 62
Type:
Small organic molecule
Emp. Form.:
C16H22N2
Mol. Mass.:
242.3593
SMILES:
NCC1CC(C1)NC1CC11CCc2ccccc12 |(5.96,-1.18,;4.47,-1.58,;3.38,-.49,;1.84,-.49,;1.84,1.05,;3.38,1.05,;.75,2.14,;-.74,1.74,;-2.22,2.14,;-1.83,.65,;-.92,-.6,;-1.83,-1.84,;-3.29,-1.37,;-4.62,-2.14,;-5.96,-1.37,;-5.96,.17,;-4.62,.94,;-3.29,.17,)|
Structure:
Search PDB for entries with ligand similarity: