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Target
Aryl hydrocarbon receptor
Ligand
BDBM50605060
Substrate
n/a
Meas. Tech.
ChEMBL_2250276 (CHEMBL5164486)
Ki
88±n/a nM
Citation
 Grycová, A; Joo, H; Maier, V; Illés, P; Vyhlídalová, B; Poulíková, K; Sládeková, L; Nádvorník, P; Vrzal, R; Zemánková, L; Pe?inková, P; Poruba, M; Zapletalová, I; Ve?e?a, R; Anzenbacher, P; Ehrmann, J; Ondra, P; Jung, JW; Mani, S; Dvo?ák, Z Targeting the Aryl Hydrocarbon Receptor with Microbial Metabolite Mimics Alleviates Experimental Colitis in Mice. J Med Chem 65:6859-6868 (2022) [PubMed] 
Target
Name:
Aryl hydrocarbon receptor
Synonyms:
AHR_MOUSE | Ah Receptor | Ahr | Aryl hydrocarbon receptor
Type:
Protein
Mol. Mass.:
95014.92
Organism:
Mus musculus (Mouse)
Description:
P30561
Residue:
848
Sequence:
MSSGANITYASRKRRKPVQKTVKPIPAEGIKSNPSKRHRDRLNTELDRLASLLPFPQDVINKLDKLSVLRLSVSYLRAKSFFDVALKSTPADRNGGQDQCRAQIRDWQDLQEGEFLLQALNGFVLVVTADALVFYASSTIQDYLGFQQSDVIHQSVYELIHTEDRAEFQRQLHWALNPDSAQGVDEAHGPPQAAVYYTPDQLPPENASFMERCFRCRLRCLLDNSSGFLAMNFQGRLKYLHGQNKKGKDGALLPPQLALFAIATPLQPPSILEIRTKNFIFRTKHKLDFTPIGCDAKGQLILGYTEVELCTRGSGYQFIHAADMLHCAESHIRMIKTGESGMTVFRLFAKHSRWRWVQSNARLIYRNGRPDYIIATQRPLTDEEGREHLQKRSTSLPFMFATGEAVLYEISSPFSPIMDPLPIRTKSNTSRKDWAPQSTPSKDSFHPSSLMSALIQQDESIYLCPPSSPAPLDSHFLMGSVSKCGSWQDSFAAAGSEAALKHEQIGHAQDVNLALSGGPSELFPDNKNNDLYNIMRNLGIDFEDIRSMQNEEFFRTDSTAAGEVDFKDIDITDEILTYVQDSLNNSTLMNSACQQQPVTQHLSCMLQERLQLEQQQQLQQPPPQALEPQQQLCQMVCPQQDLGPKHTQINGTFASWNPTPPVSFNCPQQELKHYQLFSSLQGTAQEFPYKPEVDSVPYTQNFAPCNQPLLPEHSKSVQLDFPGRDFEPSLHPTTSNLDFVSCLQVPENQSHGINSQSTMVSPQAYYAGAMSMYQCQPGPQRTPVDQTQYSSEIPGSQAFLSKVQSRGIFNETYSSDLSSIGHAAQTTGHLHHLAEARPLPDITPGGFL
  
Inhibitor
Name:
BDBM50605060
Synonyms:
CHEMBL5198290 | US11891386, Compound 004
Type:
Small organic molecule
Emp. Form.:
C14H11N3O2S
Mol. Mass.:
285.321
SMILES:
CNC(=O)c1csc(n1)C(=O)c1c[nH]c2ccccc12
Structure:
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