Reaction Details Report a problem with these data
Target
Galanin receptor type 3
Ligand
BDBM50273366
Substrate
n/a
Meas. Tech.
ChEMBL_561971 (CHEMBL1010034)
Kd
69±n/a nM
Citation
 Bulaj, G; Green, BR; Lee, HK; Robertson, CR; White, K; Zhang, L; Sochanska, M; Flynn, SP; Scholl, EA; Pruess, TH; Smith, MD; White, HS Design, synthesis, and characterization of high-affinity, systemically-active galanin analogues with potent anticonvulsant activities. J Med Chem 51:8038-47 (2008) [PubMed]  Article 
Target
Name:
Galanin receptor type 3
Synonyms:
GALNR3 | GALR3 | GALR3_HUMAN | Galanin R3 | Galanin receptor 3 | Galanin receptor type 3
Type:
Enzyme Catalytic Domain
Mol. Mass.:
39599.97
Organism:
Homo sapiens (Human)
Description:
Galanin R3 GALR3 HUMAN::O60755
Residue:
368
Sequence:
MADAQNISLDSPGSVGAVAVPVVFALIFLLGTVGNGLVLAVLLQPGPSAWQEPGSTTDLFILNLAVADLCFILCCVPFQATIYTLDAWLFGALVCKAVHLLIYLTMYASSFTLAAVSVDRYLAVRHPLRSRALRTPRNARAAVGLVWLLAALFSAPYLSYYGTVRYGALELCVPAWEDARRRALDVATFAAGYLLPVAVVSLAYGRTLRFLWAAVGPAGAAAAEARRRATGRAGRAMLAVAALYALCWGPHHALILCFWYGRFAFSPATYACRLASHCLAYANSCLNPLVYALASRHFRARFRRLWPCGRRRRHRARRALRRVRPASSGPPGCPGDARPSGRLLAGGGQGPEPREGPVHGGEAARGPE
  
Inhibitor
Name:
BDBM50273366
Synonyms:
CHEMBL499179 | GWTLNSAGYLLGPHAVGNHRSFSDKNGLT
Type:
Small organic molecule
Emp. Form.:
C136H205N41O41
Mol. Mass.:
3070.333
SMILES:
CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN)[C@@H](C)O)C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(O)=O |r,wU:12.16,102.111,81.87,4.4,60.68,43.51,93.95,155.160,202.210,139.152,166.175,123.131,182.187,29.33,wD:20.25,211.217,212.220,54.57,97.99,71.79,37.39,160.167,186.203,174.183,131.139,112.114,(97.93,-2.28,;97.93,-3.81,;99.29,-4.59,;96.58,-4.59,;96.58,-6.12,;95.25,-6.9,;93.9,-6.14,;93.9,-4.61,;92.59,-6.9,;91.24,-6.14,;89.9,-6.92,;89.9,-8.48,;88.55,-6.13,;88.55,-4.61,;89.9,-3.83,;91.25,-4.61,;89.9,-2.3,;87.21,-6.9,;85.87,-6.13,;85.87,-4.6,;84.55,-6.89,;84.55,-8.45,;85.87,-9.22,;85.87,-10.78,;87.19,-11.54,;87.17,-13.1,;83.21,-6.12,;81.87,-6.89,;81.87,-8.45,;80.52,-6.11,;80.52,-4.59,;81.87,-3.8,;83.22,-4.59,;81.87,-2.27,;79.17,-6.87,;77.83,-6.1,;77.83,-4.58,;76.5,-6.86,;76.5,-8.43,;77.8,-9.16,;75.17,-6.09,;73.85,-6.9,;73.85,-8.46,;72.5,-6.12,;72.5,-4.6,;73.85,-3.81,;75.19,-4.61,;76.53,-3.85,;76.54,-2.3,;75.22,-1.52,;73.87,-2.28,;71.14,-6.87,;69.79,-6.12,;69.79,-4.59,;68.47,-6.88,;68.47,-8.44,;69.77,-9.17,;67.13,-6.1,;65.8,-6.87,;65.8,-8.44,;64.45,-6.09,;64.45,-4.57,;65.8,-3.79,;65.8,-2.26,;67.12,-1.48,;67.11,.07,;65.77,.86,;68.46,.86,;63.11,-6.87,;61.75,-6.13,;61.75,-4.59,;60.43,-6.89,;60.43,-8.45,;61.75,-9.22,;63.16,-8.61,;64.18,-9.77,;63.41,-11.1,;61.9,-10.75,;59.12,-6.08,;57.82,-6.91,;57.82,-8.47,;56.46,-6.12,;56.46,-4.6,;57.82,-3.82,;59.15,-4.51,;57.82,-2.29,;55.11,-6.87,;53.76,-6.13,;53.76,-4.6,;52.44,-6.89,;51.12,-6.08,;49.81,-6.9,;49.81,-8.46,;48.45,-6.12,;47.06,-6.81,;45.68,-6.12,;45.68,-4.59,;44.36,-6.88,;44.36,-8.44,;43.02,-6.1,;41.68,-6.87,;41.68,-8.41,;40.34,-6.1,;40.34,-4.54,;41.69,-3.76,;43.11,-4.42,;44.15,-3.27,;43.39,-1.93,;41.87,-2.22,;39.02,-6.8,;37.69,-7.59,;36.35,-6.83,;37.71,-9.13,;38.73,-10.28,;37.96,-11.61,;36.45,-11.28,;36.29,-9.75,;34.96,-8.97,;34.97,-7.43,;33.63,-9.73,;32.3,-8.96,;30.96,-9.71,;30.96,-11.26,;29.63,-8.95,;29.64,-7.4,;30.98,-6.64,;30.99,-5.11,;32.31,-7.41,;28.29,-9.7,;26.96,-8.93,;26.97,-7.39,;25.62,-9.69,;25.61,-11.23,;26.94,-12.01,;26.94,-13.55,;28.28,-11.25,;24.29,-8.92,;22.95,-9.67,;22.94,-11.21,;21.63,-8.9,;21.63,-7.36,;22.96,-6.59,;24.29,-7.37,;25.63,-6.6,;25.64,-5.09,;26.98,-4.31,;24.31,-4.31,;22.98,-5.07,;20.29,-9.66,;18.96,-8.9,;18.96,-7.36,;17.62,-9.66,;16.29,-8.87,;14.95,-9.62,;14.95,-11.17,;13.62,-8.85,;13.63,-7.31,;12.29,-9.62,;10.96,-8.85,;10.96,-7.31,;9.62,-9.61,;9.61,-11.15,;10.97,-11.93,;8.29,-8.83,;6.95,-9.59,;6.94,-11.13,;5.62,-8.81,;5.63,-7.27,;6.97,-6.51,;8.3,-7.29,;6.97,-4.96,;4.28,-9.58,;2.96,-8.8,;2.96,-7.25,;1.63,-9.56,;1.61,-11.1,;2.94,-11.87,;2.93,-13.42,;4.28,-11.11,;.3,-8.78,;-1.04,-9.53,;-1.05,-11.07,;-2.38,-8.75,;-3.71,-9.51,;-5.04,-8.74,;-5.04,-7.19,;-6.38,-9.5,;-6.39,-11.05,;-5.06,-11.82,;-3.65,-11.21,;-2.62,-12.35,;-3.41,-13.68,;-2.93,-15.14,;-3.98,-16.28,;-5.47,-15.95,;-5.94,-14.48,;-4.9,-13.35,;-7.7,-8.71,;-9.05,-9.46,;-9.06,-11,;-10.38,-8.69,;-11.7,-9.44,;-2.37,-7.21,;-3.69,-6.43,;-1.01,-6.45,;48.45,-4.6,;49.81,-3.81,;47.13,-3.83,;97.93,-6.89,;97.93,-8.46,;99.28,-6.14,;100.62,-6.91,;100.62,-8.47,;99.26,-9.26,;101.95,-9.24,;101.93,-6.15,;103.29,-6.92,;101.93,-4.62,)|
Structure:
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