Ki Summary

Reaction Details

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Target

Solute carrier organic anion transporter family member 1B1

Ligand

BDBM50442914

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_1265864 (CHEMBL3039490)

680±n/a nM

Citation

De Bruyn, T; van Westen, GJ; Ijzerman, AP; Stieger, B; de Witte, P; Augustijns, PF; Annaert, PP Structure-based identification of OATP1B1/3 inhibitors. Mol Pharmacol83:1257-67 (2013) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Solute carrier organic anion transporter family member 1B1

Name:

Solute carrier organic anion transporter family member 1B1

Synonyms:

Type:

Protein

Mol. Mass.:

76468.06

Organism:

Homo sapiens (Human)

Description:

Q9Y6L6

Residue:

691

Sequence:

MDQNQHLNKTAEAQPSENKKTRYCNGLKMFLAALSLSFIAKTLGAIIMKSSIIHIERRFE
ISSSLVGFIDGSFEIGNLLVIVFVSYFGSKLHRPKLIGIGCFIMGIGGVLTALPHFFMGY
YRYSKETNINSSENSTSTLSTCLINQILSLNRASPEIVGKGCLKESGSYMWIYVFMGNML
RGIGETPIVPLGLSYIDDFAKEGHSSLYLGILNAIAMIGPIIGFTLGSLFSKMYVDIGYV
DLSTIRITPTDSRWVGAWWLNFLVSGLFSIISSIPFFFLPQTPNKPQKERKASLSLHVLE
TNDEKDQTANLTNQGKNITKNVTGFFQSFKSILTNPLYVMFVLLTLLQVSSYIGAFTYVF
KYVEQQYGQPSSKANILLGVITIPIFASGMFLGGYIIKKFKLNTVGIAKFSCFTAVMSLS
FYLLYFFILCENKSVAGLTMTYDGNNPVTSHRDVPLSYCNSDCNCDESQWEPVCGNNGIT
YISPCLAGCKSSSGNKKPIVFYNCSCLEVTGLQNRNYSAHLGECPRDDACTRKFYFFVAI
QVLNLFFSALGGTSHVMLIVKIVQPELKSLALGFHSMVIRALGGILAPIYFGALIDTTCI
KWSTNNCGTRGSCRTYNSTSFSRVYLGLSSMLRVSSLVLYIILIYAMKKKYQEKDINASE
NGSVMDEANLESLNKNKHFVPSAGADSETHC

BDBM50442914

n/a

Name

BDBM50442914

Synonyms:

CHEMBL3138642

Type

Small organic molecule

Emp. Form.

C27H36O7

Mol. Mass.

472.5705

SMILES

[H][C@]12C[C@H](O)C(C)(C)[C@H](CC(=O)OC)[C@@]1(C)[C@@]1([H])CC[C@@]3(C)[C@@H](OC(=O)C[C@]3(O2)C1=C)c1ccoc1 |r,THB:8:14:29:20.19.18,15:14:29:20.19.18,2:1:29:20.19.18|

Structure