Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetTryptophan 5-hydroxylase 2
LigandBDBM357761
Substrate/Competitorn/a
Meas. Tech.ChEMBL_2228294 (CHEMBL5141807)
IC50 690±n/a nM
Citation Specker, EMatthes, SWesolowski, RSchütz, AGrohmann, MAlenina, NPleimes, DMallow, KNeuenschwander, MGogolin, AWeise, MPfeifer, JZiebart, NHeinemann, Uvon Kries, JPNazaré, MBader, M Structure-Based Design of Xanthine-Benzimidazole Derivatives as Novel and Potent Tryptophan Hydroxylase Inhibitors. J Med Chem65:11126-11149 (2022) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Tryptophan 5-hydroxylase 2
Name:Tryptophan 5-hydroxylase 2
Synonyms:NTPH | TPH2 | TPH2_HUMAN
Type:PROTEIN
Mol. Mass.:56055.12
Organism:Homo sapiens (Human)
Description:ChEMBL_487490
Residue:490
Sequence:
MQPAMMMFSSKYWARRGFSLDSAVPEEHQLLGSSTLNKPNSGKNDDKGNKGSSKREAATE
SGKTAVVFSLKNEVGGLVKALRLFQEKRVNMVHIESRKSRRRSSEVEIFVDCECGKTEFN
ELIQLLKFQTTIVTLNPPENIWTEEEELEDVPWFPRKISELDKCSHRVLMYGSELDADHP
GFKDNVYRQRRKYFVDVAMGYKYGQPIPRVEYTEEETKTWGVVFRELSKLYPTHACREYL
KNFPLLTKYCGYREDNVPQLEDVSMFLKERSGFTVRPVAGYLSPRDFLAGLAYRVFHCTQ
YIRHGSDPLYTPEPDTCHELLGHVPLLADPKFAQFSQEIGLASLGASDEDVQKLATCYFF
TIEFGLCKQEGQLRAYGAGLLSSIGELKHALSDKACVKAFDPKTTCLQECLITTFQEAYF
VSESFEEAKEKMRDFAKSITRPFSVYFNPYTQSIEILKDTRSIENVVQDLRSDLNTVCDA
LNKMNQYLGI
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM357761
n/a
NameBDBM357761
Synonyms:KM-05-55 Fr10-12/(l-6) | US10214530, Example 6
TypeSmall organic molecule
Emp. Form.C21H19N7O2
Mol. Mass.401.4213
SMILESCn1c2nc(Cc3nc4ccc(N)cc4[nH]3)n(Cc3ccccc3)c2c(=O)[nH]c1=O
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: