Ki Summary

Reaction Details

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Target

Hormone-sensitive lipase

Ligand

BDBM50613579

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_2292575

IC50

570±n/a nM

Citation

Kuhn, B; Guba, W; Hert, J; Banner, D; Bissantz, C; Ceccarelli, S; Haap, W; K�rner, M; Kuglstatter, A; Lerner, C; Mattei, P; Neidhart, W; Pinard, E; Rudolph, MG; Schulz-Gasch, T; Woltering, T; Stahl, M A Real-World Perspective on Molecular Design. J Med Chem59:4087-102 (2016) [PubMed]

More Info.:

Get all data from this article, Assay Method

Hormone-sensitive lipase

Name:

Hormone-sensitive lipase

Synonyms:

HSL | Hormone sensitive lipase | Hormone-sensitive lipase (HSL) | LIPE | LIPS_HUMAN

Type:

Protein

Mol. Mass.:

116599.07

Organism:

Homo sapiens (Human)

Description:

Q05469

Residue:

1076

Sequence:

MEPGSKSVSRSDWQPEPHQRPITPLEPGPEKTPIAQPESKTLQGSNTQQKPASNQRPLTQ
QETPAQHDAESQKEPRAQQKSASQEEFLAPQKPAPQQSPYIQRVLLTQQEAASQQGPGLG
KESITQQEPALRQRHVAQPGPGPGEPPPAQQEAESTPAAQAKPGAKREPSAPTESTSQET
PEQSDKQTTPVQGAKSKQGSLTELGFLTKLQELSIQRSALEWKALSEWVTDSESESDVGS
SSDTDSPATMGGMVAQGVKLGFKGKSGYKVMSGYSGTSPHEKTSARNHRHYQDTASRLIH
NMDLRTMTQSLVTLAEDNIAFFSSQGPGETAQRLSGVFAGVREQALGLEPALGRLLGVAH
LFDLDPETPANGYRSLVHTARCCLAHLLHKSRYVASNRRSIFFRTSHNLAELEAYLAALT
QLRALVYYAQRLLVTNRPGVLFFEGDEGLTADFLREYVTLHKGCFYGRCLGFQFTPAIRP
FLQTISIGLVSFGEHYKRNETGLSVAASSLFTSGRFAIDPELRGAEFERITQNLDVHFWK
AFWNITEMEVLSSLANMASATVRVSRLLSLPPEAFEMPLTADPTLTVTISPPLAHTGPGP
VLVRLISYDLREGQDSEELSSLIKSNGQRSLELWPRPQQAPRSRSLIVHFHGGGFVAQTS
RSHEPYLKSWAQELGAPIISIDYSLAPEAPFPRALEECFFAYCWAIKHCALLGSTGERIC
LAGDSAGGNLCFTVALRAAAYGVRVPDGIMAAYPATMLQPAASPSRLLSLMDPLLPLSVL
SKCVSAYAGAKTEDHSNSDQKALGMMGLVRRDTALLLRDFRLGASSWLNSFLELSGRKSQ
KMSEPIAEPMRRSVSEAALAQPQGPLGTDSLKNLTLRDLSLRGNSETSSDTPEMSLSAET
LSPSTPSDVNFLLPPEDAGEEAEAKNELSPMDRGLGVRAAFPEGFHPRRSSQGATQMPLY
SSPIVKNPFMSPLLAPDSMLKSLPPVHIVACALDPMLDDSVMLARRLRNLGQPVTLRVVE
DLPHGFLTLAALCRETRQAAELCVERIRLVLTPPAGAGPSGETGAAGVDGGCGGRH

BDBM50613579

n/a

Name

BDBM50613579

Synonyms:

CHEMBL5290812

Type

Small organic molecule

Emp. Form.

C19H24F3NO3

Mol. Mass.

371.394

SMILES

CCC[C@@]1(O)CC[C@]2(CCN(C2=O)c2ccc(OC(F)(F)F)cc2)CC1 |r,wU:7.7,wD:3.2,(3.96,-17.44,;5.31,-16.7,;6.63,-17.5,;7.98,-16.77,;6.67,-15.97,;8.72,-18.13,;10.26,-18.17,;11.07,-16.87,;11.8,-15.52,;13.31,-15.8,;13.51,-17.33,;12.12,-17.99,;11.84,-19.5,;14.87,-18.06,;14.9,-19.6,;16.25,-20.34,;17.56,-19.53,;18.92,-20.27,;18.96,-21.8,;20.31,-22.54,;17.65,-22.61,;18.91,-23.34,;17.52,-17.98,;16.17,-17.26,;10.33,-15.5,;8.8,-15.46,)|

Structure