Reaction Details Report a problem with these data
Target
Equilibrative nucleoside transporter 1
Ligand
BDBM23617
Substrate
n/a
Meas. Tech.
ChEMBL_321555 (CHEMBL881969)
IC50
0.30±n/a nM
Citation
Minetti, P; Tinti, MO; Carminati, P; Castorina, M; Di Cesare, MA; Di Serio, S; Gallo, G; Ghirardi, O; Giorgi, F; Giorgi, L; Piersanti, G; Bartoccini, F; Tarzia, G 2-n-Butyl-9-methyl-8-[1,2,3]triazol-2-yl-9H-purin-6-ylamine and analogues as A2A adenosine receptor antagonists. Design, synthesis, and pharmacological characterization. J Med Chem 48:6887-96 (2005) [PubMed] Article
More Info.:
Target
Name:
Equilibrative nucleoside transporter 1
Synonyms:
Ent1 | S29A1_RAT | Slc29a1
Type:
PROTEIN
Mol. Mass.:
50023.68
Organism:
Rattus norvegicus
Description:
ChEMBL_181682
Residue:
457
Sequence:
MTTSHQPQDRYKAVWLIFFVLGLGTLLPWNFFITATQYFTSRLNTSQNISLVTNQSCESTEALADPSVSLPARSSLSAIFNNVMTLCAMLPLLIFTCLNSFLHQKVSQSLRILGSLLAILLVFLVTATLVKVQMDALSFFIITMIKIVLINSFGAILQASLFGLAGVLPANYTAPIMSGQGLAGFFTSVAMICAVASGSKLSESAFGYFITACAVVILAILCYLALPWMEFYRHYLQLNLAGPAEQETKLDLISEGEEPRGGREESGVPGPNSLPANRNQSIKAILKSIWVLALSVCFIFTVTIGLFPAVTAEVESSIAGTSPWKNCYFIPVACFLNFNVFDWLGRSLTAICMWPGQDSRWLPVLVACRVVFIPLLMLCNVKQHHYLPSLFKHDVWFITFMAAFAFSNGYLASLCMCFGPKKVKPAEAETAGNIMSFFLCLGLALGAVLSFLLRALV
Inhibitor
Name:
BDBM23617
Synonyms:
(2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-{[(4-nitrophenyl)methyl]sulfanyl}-9H-purin-9-yl)oxolane-3,4-diol | 4-nitrobenzylmercaptopurine ribonucleoside | CHEMBL418509 | NBMPR | NBTI | Nitrobenzylthioinosine
Type:
Small organic molecule
Emp. Form.:
C17H17N5O6S
Mol. Mass.:
419.412
SMILES:
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(SCc3ccc(cc3)[N+]([O-])=O)ncnc12