Ki Summary

Reaction Details

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Target

Transporter

Ligand

BDBM50196228

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_418047 (CHEMBL911775)

440±n/a nM

Citation

Zou, MF; Cao, J; Kopajtic, T; Desai, RI; Katz, JL; Newman, AH Structure-activity relationship studies on a novel series of (S)-2beta-substituted 3alpha-[bis(4-fluoro- or 4-chlorophenyl)methoxy]tropane analogues for in vivo investigation. J Med Chem49:6391-9 (2006) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Transporter

Name:

Transporter

Synonyms:

Monoamine transporters; Norepininephrine & dopamine | Norepinephrine Monoamine transporters

Type:

PROTEIN

Mol. Mass.:

66787.87

Organism:

Rattus norvegicus

Description:

ChEMBL_1463061

Residue:

597

Sequence:

MVTRTRETWGKKIDFLLSVVGFAVDLANVWRFPYLCYKNGGGAFLIPYTLFLIIAGMPLF
YMELALGQFNREGAATVWKICPFFKGVGYAVILIALYVGFYYNVIIAWSLYYLFASFTLN
LPWTNCGHAWNSPNCTDPKLLNASVLGDHTKYSKYKFTPAAEFYERGVLHLHESSGIHDI
GLPQWQLLLCLMVVIVVLYVSLWKGVKTSGKVVWITATLPYFVLFVLLVHGVTLPGASNG
INAYLHIDFYRLKEATVWIDAATQIFFSLGAGFGVLIAFASYNKFDNNCYRDALLTSTIN
CVTSFISGFAIFSILGYMAHEHKVKIEDVATEGAGLVFVLYPEAISTLSGSTFWAVLFFL
MLLALGLDSSMGGMEAVITGLADDFQVLKRHRKLFTCAVTLGTFLLAMFCITKGGIYVLT
LLDTFAAGTSILFAVLMEAIGVSWFYGVDRFSNDIQQMMGFKPGLYWRLCWKFVSPAFLL
FVVVVSIINFKPLTYDDYVYPPWANWVGWGIALSSMILVPAYVIYKFFSIRGSLWERVAY
GITPENEHHLLALEIELSSLQSFVITSCPIDPLLSSFLFISCQKTLVFKKSGPAPLI

BDBM50196228

n/a

Name

BDBM50196228

Synonyms:

CHEMBL217160 | S-(-)-2beta-{[4-(4'-Aminophenyl)butyryl]oxymethyl}-3alpha-[bis(4-fluorophenyl) methoxy]tropane

Type

Small organic molecule

Emp. Form.

C32H36F2N2O3

Mol. Mass.

534.6366

SMILES

CN1C2CCC1[C@@H](COC(=O)CCCc1ccc(N)cc1)[C@H](C2)OC(c1ccc(F)cc1)c1ccc(F)cc1 |TLB:7:6:1:3.4,THB:23:21:1:3.4|

Structure