Ki Summary

Reaction Details

Report a problem with these data

Target

Neuropeptide Y receptor type 1

Ligand

BDBM50197016

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_453178 (CHEMBL902328)

>1000±n/a nM

Citation

DeCarr, LB; Buckholz, TM; Coish, PD; Fathi, Z; Fisk, SE; Mays, MR; O'Connor, SJ; Lumb, KJ Identification of selective neuropeptide Y2 peptide agonists. Bioorg Med Chem Lett17:538-41 (2007) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Neuropeptide Y receptor type 1

Name:

Neuropeptide Y receptor type 1

Synonyms:

Type:

Enzyme Catalytic Domain

Mol. Mass.:

44399.07

Organism:

Homo sapiens (Human)

Description:

NPY-Y1 NPY1R HUMAN::P25929

Residue:

384

Sequence:

MNSTLFSQVENHSVHSNFSEKNAQLLAFENDDCHLPLAMIFTLALAYGAVIILGVSGNLA
LIIIILKQKEMRNVTNILIVNLSFSDLLVAIMCLPFTFVYTLMDHWVFGEAMCKLNPFVQ
CVSITVSIFSLVLIAVERHQLIINPRGWRPNNRHAYVGIAVIWVLAVASSLPFLIYQVMT
DEPFQNVTLDAYKDKYVCFDQFPSDSHRLSYTTLLLVLQYFGPLCFIFICYFKIYIRLKR
RNNMMDKMRDNKYRSSETKRINIMLLSIVVAFAVCWLPLTIFNTVFDWNHQIIATCNHNL
LFLLCHLTAMISTCVNPIFYGFLNKNFQRDLQFFFNFCDFRSRDDDYETIAMSTMHTDVS
KTSLKQASPVAFKKINNNDDNEKI

BDBM50197016

n/a

Name

BDBM50197016

Synonyms:

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(3-aminocyclohexyl)formamido]-5-carbamimidamidopentanamido]-3-(1H-imidazol-5-yl)propanamido]-3-(4-hydroxyphenyl)propanamido]-4-methylpentanamido]-3-carbamoylpropanamido]-4-methylpentanamido]-3-methylbutanamido]-3-hydroxybutanamido]-5-carbamimidamidopentanamido]-N-[(1S)-4-carbamimidamido-1-{[(1S)-1-carbamoyl-2-(4-hydroxyphenyl)ethyl]carbamoyl}butyl]pentanediamide | CHEMBL397529

Type

Small organic molecule

Emp. Form.

C79H127N27O18

Mol. Mass.

1743.0238

SMILES

CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCCN=C(N)N)NC(=O)C1CCCC(N)C1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |w:41.42,wU:74.76,75.79,4.4,92.94,20.28,59.61,112.114,wD:67.69,8.17,30.39,81.83,51.53,101.103,(13.62,-30.43,;13.62,-31.97,;14.96,-32.74,;12.29,-32.74,;12.29,-34.28,;10.95,-35.04,;9.62,-34.27,;9.62,-32.73,;8.29,-35.04,;8.29,-36.58,;9.62,-37.35,;10.95,-36.58,;12.29,-37.35,;12.29,-38.89,;13.6,-39.65,;10.95,-39.66,;9.62,-38.89,;6.95,-34.27,;5.63,-35.06,;5.63,-36.6,;4.3,-34.29,;4.3,-32.75,;5.63,-31.98,;7.03,-32.61,;8.07,-31.46,;7.3,-30.13,;5.79,-30.44,;2.96,-35.05,;1.62,-34.28,;1.62,-32.74,;.29,-35.05,;.29,-36.59,;1.62,-37.36,;1.62,-38.9,;2.96,-39.67,;2.97,-41.21,;1.62,-41.97,;4.28,-41.97,;-1.04,-34.28,;-2.37,-35.07,;-2.36,-36.61,;-3.7,-34.3,;-3.7,-32.76,;-5.03,-31.99,;-6.37,-32.76,;-6.36,-34.31,;-7.69,-35.09,;-5.03,-35.07,;13.62,-35.05,;13.62,-36.59,;14.95,-34.27,;16.28,-35.04,;16.28,-36.58,;17.61,-37.35,;18.94,-36.58,;17.61,-38.89,;17.61,-34.27,;17.61,-32.73,;18.94,-35.04,;20.28,-34.28,;20.28,-32.74,;21.61,-31.97,;21.61,-30.43,;22.95,-32.74,;21.61,-35.05,;21.61,-36.59,;22.94,-34.27,;24.27,-35.04,;24.27,-36.58,;25.6,-37.35,;22.94,-37.35,;25.6,-34.27,;25.6,-32.73,;26.94,-35.04,;28.27,-34.27,;28.27,-32.73,;26.94,-31.96,;29.6,-31.96,;29.6,-35.04,;29.6,-36.58,;30.93,-34.27,;32.26,-35.04,;32.26,-36.58,;33.59,-37.35,;33.59,-38.89,;34.93,-39.65,;34.93,-41.19,;33.59,-41.96,;36.27,-41.96,;33.59,-34.27,;33.59,-32.73,;34.93,-35.04,;36.27,-34.27,;36.27,-32.73,;37.59,-31.96,;37.59,-30.42,;36.26,-29.65,;38.93,-29.65,;37.59,-35.04,;37.59,-36.58,;38.93,-34.27,;40.26,-35.04,;40.26,-36.58,;41.59,-37.35,;41.59,-38.89,;42.92,-39.66,;42.92,-41.2,;41.59,-41.96,;44.26,-41.96,;41.59,-34.27,;41.59,-32.73,;42.92,-35.04,;44.26,-34.27,;44.26,-32.73,;45.59,-31.96,;46.92,-32.73,;48.26,-31.96,;48.26,-30.42,;49.59,-29.65,;46.92,-29.65,;45.59,-30.42,;45.59,-35.04,;46.92,-34.27,;45.59,-36.58,)|

Structure