Ki Summary

Reaction Details

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Target

P2Y purinoceptor 6

Ligand

BDBM50496863

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_1330934 (CHEMBL3224914)

EC50

9.0±n/a nM

Citation

Jayasekara, PS; Barrett, MO; Ball, CB; Brown, KA; Kozma, E; Costanzi, S; Squarcialupi, L; Balasubramanian, R; Maruoka, H; Jacobson, KA 4-Alkyloxyimino-cytosine nucleotides: tethering approaches to molecular probes for the P2Y Medchemcomm4:1156-1165 (2013) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

P2Y purinoceptor 6

Name:

P2Y purinoceptor 6

Synonyms:

P2RY6 | P2RY6_HUMAN | P2Y purinoceptor 6 | P2Y6 | Pyrimidinergic receptor P2Y6

Type:

PROTEIN

Mol. Mass.:

36452.29

Organism:

Homo sapiens (Human)

Description:

ChEMBL_1511151

Residue:

328

Sequence:

MEWDNGTGQALGLPPTTCVYRENFKQLLLPPVYSAVLAAGLPLNICVITQICTSRRALTR
TAVYTLNLALADLLYACSLPLLIYNYAQGDHWPFGDFACRLVRFLFYANLHGSILFLTCI
SFQRYLGICHPLAPWHKRGGRRAAWLVCVAVWLAVTTQCLPTAIFAATGIQRNRTVCYDL
SPPALATHYMPYGMALTVIGFLLPFAALLACYCLLACRLCRQDGPAEPVAQERRGKAARM
AVVVAAAFAISFLPFHITKTAYLAVRSTPGVPCTVLEAFAAAYKGTRPFASANSVLDPIL
FYFTQKKFRRRPHELLQKLTAKWQRQGR

BDBM50496863

n/a

Name

BDBM50496863

Synonyms:

CHEMBL3220052

Type

Small organic molecule

Emp. Form.

C55H66N10O22P2S2

Mol. Mass.

1345.244

SMILES

CCN(CC)CC.Nc1ccc2c(-c3ccc(cc3C(O)=O)C(=O)NCCCCCCn3cc(CCC#Cc4cccc(CO\N=c5\ccn([C@@H]6O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]6O)c(=O)[nH]5)c4)nn3)c3ccc(=N)c(c3oc2c1S(O)(=O)=O)S(O)(=O)=O |r,wU:50.49,52.52,wD:63.63,65.66,(35.46,-11.01,;34.13,-10.24,;32.79,-11.01,;31.46,-10.24,;31.46,-8.7,;32.79,-12.55,;31.46,-13.32,;35.68,-5.99,;37,-6.79,;36.96,-8.35,;38.29,-9.15,;39.64,-8.41,;40.96,-9.2,;40.93,-10.74,;39.58,-11.49,;39.56,-13.03,;40.87,-13.81,;42.22,-13.07,;42.25,-11.53,;43.6,-10.79,;44.92,-11.58,;44.66,-9.67,;40.85,-15.35,;42.17,-16.15,;39.5,-16.1,;39.47,-17.64,;38.12,-18.38,;38.1,-19.92,;36.75,-20.67,;36.72,-22.21,;35.38,-22.96,;35.35,-24.5,;33.85,-24.86,;33.74,-26.39,;32.43,-27.2,;31.08,-26.47,;29.77,-27.28,;28.46,-28.09,;27.15,-28.9,;27.2,-30.45,;25.88,-31.26,;24.53,-30.52,;24.5,-28.99,;23.14,-28.25,;21.83,-29.06,;20.48,-28.32,;19.16,-29.13,;17.81,-28.4,;16.49,-29.21,;16.54,-30.74,;15.22,-31.55,;13.96,-30.66,;12.73,-31.59,;11.39,-30.84,;10.07,-31.63,;8.72,-30.89,;9.41,-29.5,;7.87,-29.58,;7.4,-31.68,;6.05,-30.93,;4.73,-31.72,;4.96,-29.83,;6.81,-29.58,;13.23,-33.04,;12.35,-34.3,;14.77,-33.02,;15.7,-34.25,;17.88,-31.47,;17.92,-33.01,;19.2,-30.67,;25.8,-28.18,;35.16,-26.98,;36.16,-25.81,;42.31,-8.46,;43.62,-9.25,;44.97,-8.5,;44.99,-6.96,;46.34,-6.21,;43.68,-6.18,;42.34,-6.92,;41.02,-6.13,;39.68,-6.86,;38.36,-6.05,;38.4,-4.51,;39.75,-3.78,;37.07,-5.3,;37.28,-3.44,;43.7,-4.64,;45.05,-3.89,;42.16,-4.67,;42.88,-3.32,)|

Structure