Ki Summary

Reaction Details

Report a problem with these data

Target

Cholecystokinin receptor type A

Ligand

BDBM50286167

Substrate/Competitor

n/a

Meas. Tech.

ChEBML_49403

IC50

1700±n/a nM

Citation

Holladay, MW; Bennett, MJ; Bai, H; Ralston, JW; Kerwin, JF; Stashko, M; Miller, TR; O'Neill, AB; Nadzan, AM; Brioni, J; Lin, CW Amino acid-derived piperidides as novel CCK_B ligands with anxiolytic-like properties Bioorg Med Chem Lett5:3057-3062 (1995) Article

More Info.:

Get all data from this article, Assay Method

Cholecystokinin receptor type A

Name:

Cholecystokinin receptor type A

Synonyms:

Type:

n/a

Mol. Mass.:

48229.77

Organism:

Cavia porcellus

Description:

n/a

Residue:

430

Sequence:

MDVVDSLFVNGSNITSACELGFENETLFCLDRPRPSKEWQPAVQILLYSLIFLLSVLGNT
LVITVLIRNKRMRTVTNIFLLSLAVSDLMLCLFCMPFNLIPSLLKDFIFGSAVCKTTTYF
MGTSVSVSTFNLVAISLERYGAICKPLQSRVWQTKSHALKVIAATWCLSFTIMTPYPIYS
NLVPFTKNNNQTGNMCRFLLPNDVMQQTWHTFLLLILFLIPGIVMMVAYGLISLELYQGI
KFDAIQKKSAKERKTSTGSSGPMEDSDGCYLQKSRHPRKLELRQLSPSSSGSNRINRIRS
SSSTANLMAKKRVIRMLIVIVVLFFLCWMPIFSANAWRAYDTVSAERHLSGTPISFILLL
SYTSSCVNPIIYCFMNKRFRLGFMATFPCCPNPGTPGVRGEMGEEEEGRTTGASLSRYSY
SHMSTSAPPP

BDBM50286167

n/a

Name

BDBM50286167

Synonyms:

CHEMBL105618 | [2-(4-Benzoyl-piperidin-1-yl)-1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-ethyl]-carbamic acid adamantan-2-yl ester

Type

Small organic molecule

Emp. Form.

C35H41N3O4

Mol. Mass.

567.7177

SMILES

CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N1CCC(CC1)C(=O)c1ccccc1 |wU:19.20,23.24,wD:21.28,17.19,TLB:15:16:22:19.24.20,THB:18:17:22:19.24.20,18:19:22:16.17.25,(8.81,-8.94,;9.18,-7.46,;9.26,-5.91,;10.31,-4.78,;11.84,-4.96,;12.48,-3.56,;11.34,-2.53,;11.38,-1,;10.06,-.2,;8.73,-.97,;8.71,-2.49,;10.01,-3.27,;7.8,-8.14,;6.52,-7.3,;6.59,-5.76,;5.2,-8.09,;3.84,-7.35,;3.29,-5.95,;2.01,-5.32,;.94,-6.35,;-.8,-6.39,;.54,-7.16,;1.12,-8.57,;2.75,-8.41,;1.53,-7.64,;1.68,-6.06,;10.47,-8.29,;10.38,-9.83,;11.84,-7.59,;12.89,-6.46,;14.33,-7.44,;15.66,-7.31,;14.61,-8.46,;13.09,-7.46,;16.79,-8.38,;16.42,-9.88,;18.25,-7.94,;18.6,-6.45,;20.08,-6,;21.21,-7.07,;20.85,-8.57,;19.37,-9,)|

Structure