Ki Summary

Reaction Details

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Target

Neuropeptide FF receptor 2

Ligand

BDBM86148

Substrate

n/a

23±n/a nM

Comments

PDSP_2994

Citation

Engstr�m, M; Brandt, A; Wurster, S; Savola, JM; Panula, P Prolactin releasing peptide has high affinity and efficacy at neuropeptide FF2 receptors. J Pharmacol Exp Ther 305:825-32 (2003) [PubMed] Article

More Info.:

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Target

Name:

Neuropeptide FF receptor 2

Synonyms:

Type:

Enzyme Catalytic Domain

Mol. Mass.:

60293.78

Organism:

Homo sapiens (Human)

Description:

NPFF2 0 HUMAN::Q9Y5X5

Residue:

522

Sequence:

MNSFFGTPAASWCLLESDVSSAPDKEAGRERRALSVQQRGGPAWSGSLEWSRQSAGDRRRLGLSRQTAKSSWSRSRDRTCCCRRAWWILVPAADRARRERFIMNEKWDTNSSENWHPIWNVNDTKHHLYSDINITYVNYYLHQPQVAAIFIISYFLIFFLCMMGNTVVCFIVMRNKHMHTVTNLFILNLAISDLLVGIFCMPITLLDNIIAGWPFGNTMCKISGLVQGISVAASVFTLVAIAVDRFQCVVYPFKPKLTIKTAFVIIMIIWVLAITIMSPSAVMLHVQEEKYYRVRLNSQNKTSPVYWCREDWPNQEMRKIYTTVLFANIYLAPLSLIVIMYGRIGISLFRAAVPHTGRKNQEQWHVVSRKKQKIIKMLLIVALLFILSWLPLWTLMMLSDYADLSPNELQIINIYIYPFAHWLAFGNSSVNPIIYGFFNENFRRGFQEAFQLQLCQKRAKPMEAYALKAKSHVLINTSNQLVQESTFQNPHGETLLYRKSAEKPQQELVMEELKETTNSSEI

Inhibitor

Name:

BDBM86148

Synonyms:

CAS_222988-10-5 | PrRP20

Type:

Small organic molecule

Emp. Form.:

C104H158N32O26

Mol. Mass.:

2272.5661

SMILES:

CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,wU:31.40,57.60,77.81,101.106,89.92,111.115,96.101,98.104,125.131,151.156,wD:43.56,27.27,62.64,105.111,69.77,12.19,81.89,4.4,2.2,129.134,140.145,(11.09,9.04,;9.83,9.87,;8.5,9.19,;8.39,7.7,;7.21,10.07,;5.85,9.36,;5.77,7.85,;7.06,7,;4.44,7.12,;4.34,5.63,;3.08,4.78,;1.87,5.53,;3.05,3.19,;4.36,2.33,;5.77,3.06,;7.06,2.26,;8.39,2.96,;9.71,2.08,;11.09,2.81,;9.68,.54,;1.69,2.51,;1.51,1,;2.75,.16,;.1,.26,;.05,-1.27,;-1.31,-1.95,;-2.57,-1.1,;-1.39,-3.47,;-2.72,-4.12,;-2.72,-5.66,;-1.39,-6.52,;-4.11,-6.37,;-5.39,-5.51,;-5.32,-3.97,;-6.6,-3.14,;-6.45,-1.58,;-5.09,-.92,;-4.94,.64,;-3.83,-1.75,;-3.93,-3.34,;-4.16,-7.88,;-5.52,-8.56,;-6.81,-7.75,;-5.57,-10.1,;-4.29,-10.95,;-2.92,-10.2,;-2.77,-8.68,;-1.26,-8.31,;-.45,-9.67,;1.03,-10.02,;1.56,-11.53,;.45,-12.54,;-1.06,-12.34,;-1.56,-10.85,;-6.91,-10.8,;-6.93,-12.34,;-5.65,-13.2,;-8.27,-13.1,;-9.63,-12.24,;-8.37,-14.63,;-9.81,-15.21,;-11.14,-14.36,;-9.93,-16.68,;-8.77,-17.76,;-9.48,-19.17,;-11.02,-18.99,;-11.27,-17.46,;-12.68,-16.85,;-12.68,-15.42,;-13.96,-17.66,;-13.99,-19.2,;-12.6,-19.98,;-11.27,-19.17,;-12.6,-21.46,;-15.33,-16.85,;-16.71,-17.58,;-16.66,-19.1,;-18.05,-16.8,;-19.36,-17.58,;-20.67,-16.75,;-20.67,-15.21,;-22.01,-17.53,;-22.03,-19.12,;-20.67,-19.85,;-19.33,-19.07,;-20.67,-21.44,;-23.37,-16.78,;-24.65,-17.63,;-24.65,-19.3,;-25.99,-16.9,;-26.24,-15.39,;-27.78,-15.14,;-28.54,-16.55,;-27.38,-17.63,;-27.58,-19.2,;-26.37,-20.08,;-29.04,-19.8,;-29.19,-21.39,;-30.33,-18.87,;-31.76,-19.5,;-30.15,-17.33,;-18.05,-15.26,;-19.38,-14.46,;-16.71,-14.51,;-16.69,-12.92,;-.13,-4.3,;-.2,-5.81,;1.24,-3.62,;7.26,11.53,;6.05,12.36,;8.62,12.21,;8.65,13.7,;7.36,14.63,;7.44,16.2,;6.2,17.03,;6.28,18.57,;4.94,19.45,;5.04,21.01,;3.5,18.77,;10.08,14.48,;11.29,13.65,;10.31,15.99,;9.2,17.08,;9.93,18.46,;11.44,18.24,;11.7,16.75,;12.98,15.99,;12.98,14.41,;14.29,16.85,;15.6,16.1,;15.63,14.58,;14.32,13.75,;16.94,13.8,;16.89,16.88,;16.86,18.41,;18.2,16.12,;19.49,16.85,;20.85,16.12,;20.82,14.66,;22.21,16.8,;23.52,16.02,;23.49,14.43,;24.86,13.62,;24.83,12.14,;26.12,11.33,;26.09,9.79,;27.4,8.99,;24.78,9.01,;24.88,16.8,;24.88,18.26,;26.24,16.12,;27.6,16.85,;27.63,18.36,;28.99,19.2,;30.33,18.34,;31.74,19.12,;31.76,20.66,;30.45,21.46,;29.04,20.71,;28.89,16.12,;30.15,16.98,;28.86,14.48,)|

Structure: