Cystetine Triphosphate

Cystetine Triphosphate

SCHEMBL28754273

Nc1ccn([C@@H]2O[C@H](COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])[C@@H](O)[C@H]2O)c(=O)n1.OCC(O)C(O)C(O)CO.[Na+].[Na+].[Na+].[Na+]

nearest known ligand 0.72

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Cystetine Triphosphate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
P2RY2 known ✓ P41231 4/20 0.61
P2RY4 known ✓ P51582 2/20 0.61
P2RY6 known ✓ Q15077 2/20 0.56
THRB known ✓ P10828 1/20 0.55
TSHR P16473 1/20 0.72
GLA P06280 1/20 0.72
ST6GAL1 P15907 10/20 0.64
LMNA P02545 1/20 0.55
MTOR P42345 1/20 0.55
MDM2 Q00987 1/20 0.55
NCOA1 Q15788 1/20 0.55
NCOA3 Q9Y6Q9 1/20 0.55
NT5E P21589 1/20 0.54

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Cystetine Triphosphate SCHEMBL27792998 0.99 TSHR (0.71) TSHRGLAST6GAL1P2RY2P2RY4
Cystetine Triphosphate SCHEMBL9101211 0.93 TSHR (0.81) TSHRGLAST6GAL1P2RY2P2RY4
Cystetine Triphosphate SCHEMBL31405617 0.92 TSHR (0.80) TSHRGLAST6GAL1P2RY2P2RY4
Cystetine Triphosphate SCHEMBL10826769 0.92 TSHR (0.80) TSHRGLAST6GAL1P2RY2P2RY4
SCHEMBL5407898 0.91 TSHR (0.81) TSHRGLAST6GAL1P2RY2P2RY4
SCHEMBL29356399 0.91 TSHR (0.81) TSHRGLAST6GAL1P2RY2P2RY4
Potassium Ion SCHEMBL10585798 0.90 TSHR (0.80) TSHRGLAST6GAL1P2RY2P2RY4
Cystetine Triphosphate SCHEMBL11613107 0.88 TSHR (0.79) TSHRGLAST6GAL1P2RY2P2RY4
Cystetine Triphosphate SCHEMBL2194120 0.88 TSHR (0.79) TSHRGLAST6GAL1P2RY2P2RY4
Cystetine Triphosphate SCHEMBL27771998 0.86 TSHR (0.55) TSHRGLAST6GAL1P2RY2P2RY4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1616104-A Transfusion medicine prepared from xylitol as istonic regulator and various injections separately and its preparing method CUI XIAOTING (CN) 2005-05-18 CN disclosed