SCHEMBL4209829

SCHEMBL4209829

NCCCCCCNc1nc2c(N)ncnc2n1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O

nearest known ligand 0.81

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ENTPD1 P49961 3/20 0.66
▸ FBP1 P09467 1/20 0.59
▸ NT5E P21589 1/20 0.58
▸ TRPM2 O94759 1/20 0.57

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
SCHEMBL4206199 0.99 ENTPD1 (0.67) ENTPD1FBP1NT5ETRPM2
SCHEMBL20266254 0.94 FBP1 (0.63) ENTPD1FBP1TRPM2
SCHEMBL8388000 0.93 FBP1 (0.64) ENTPD1FBP1TRPM2
SCHEMBL14178288 0.90 ENTPD1 (0.71) ENTPD1FBP1TRPM2
SCHEMBL20529826 0.89 P2RY1 (0.65) FBP1NT5ETRPM2
Lithium Ion SCHEMBL20266257 0.88 FBP1 (0.60) ENTPD1FBP1NT5E
Lithium Ion SCHEMBL30999928 0.88 FBP1 (0.60) ENTPD1FBP1NT5E
Adenosine Phosphate SCHEMBL31666008 0.87 P2RY1 (0.69) FBP1NT5ETRPM2
SCHEMBL7699161 0.87 ENTPD1 (0.66) ENTPD1TRPM2
SCHEMBL6894217 0.87 ENTPD1 (0.66) ENTPD1TRPM2

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0232967-B1 COMPETITIVE HOMOGENEOUS ASSAY AMOCO CORPORATION (US) 1993-04-28 — — EP claimed
JP-2075957-A — — None — — JP disclosed
US-20090104633-A1 Kit for Highly Sensitive Detection Assays VYZKUMNY USTAV VETERINARNIHO LEKARSTVI (CZ) 2009-04-23 — — US disclosed
WO-2007051604-A2 NOVEL 2,4-DICHLOROPHENOXY ACETIC ACID DERIVATIVES AND USE THEREOF IN DIAGNOSTIC AND ANALYTIC DETECTION METHODS FORSCHUNGSZENTRUM BORSTEL (DE) 2007-05-10 — — WO disclosed
US-5928862-A CONTACTING SAMPLE WITH LABELED POLYNUCLEOTIDE PROBES CAPABLE OF TWO POSTIONS, EITHER BOUND TO EACH OTHER WHERE LABELS CAN INTERACT OR ONE BOUND TO TARGET IN SAMPLE; MONITORING FOR SIGNAL INDICATIVE OF PRESENCE OF TARGET AMOCO CORPORATION (US) 1999-07-27 — — US disclosed
EP-0527433-B1 Novel fluorescent label BAYER AG (US) 1997-01-08 — — EP disclosed
US-5587472-A FLUORESCENT LABEL BAYER CORPORATION (US) 1996-12-24 — — US disclosed
EP-0232967-B1 COMPETITIVE HOMOGENEOUS ASSAY AMOCO CORPORATION (US) 1993-04-28 — — EP disclosed
EP-0527433-A1 Novel fluorescent label Bayer Corporation (US) 1993-02-17 — — EP disclosed
EP-0097666-B1 METHOD FOR DOSING BIOLOGICAL SUBSTANCES CAPABLE OF FIXING DEGRADATION PRODUCTS OF ADENOSINE 5'-TRIPHOSPHORIC ACID INSTITUT PASTEUR (FR) 1992-08-19 — — EP disclosed
JP-H0275957-A METHOD FOR LABELING DNA WITH FLUORESCENT DYE KAO CORP 1990-03-15 — — JP disclosed
EP-0232967-A2 Competitive homogeneous Assay AMOCO CORPORATION (US) 1987-08-19 — — EP disclosed
EP-0097667-B1 DNA FRAGMENTS MARKED AT LEAST AT ONE OF THE ENDS THEREOF BY MODIFIED RIBONUCLEOTIDES RECOGNIZABLE BY RELATED MOLECULES AND METHOD FOR ANALYZING SUCH DNA FRAGMENTS INSTITUT PASTEUR (FR) 1987-03-25 — — EP disclosed
EP-0097667-A1 DNA FRAGMENTS MARKED AT LEAST AT ONE OF THE ENDS THEREOF BY MODIFIED RIBONUCLEOTIDES RECOGNIZABLE BY RELATED MOLECULES AND METHOD FOR ANALYZING SUCH DNA FRAGMENTS. PASTEUR INSTITUT (FR) 1984-01-11 — — EP disclosed
EP-0097666-A1 METHOD FOR DOSING BIOLOGICAL SUBSTANCES CAPABLE OF FIXING DEGRADATION PRODUCTS OF ADENOSINE 5'-TRIPHOSPHORIC ACID. PASTEUR INSTITUT (FR) 1984-01-11 — — EP disclosed
WO-1983002276-A1 MODIFIED ADENOSINE 5'-TRIPHOSPHORIC ACID AND METHOD FOR DOSING BIOLOGICAL SUBSTANCES CAPABLE OF FIXING DEGRADATION PRODUCTS OF ADENOSINE 5'-TRIPHOSPHORIC ACID KOURILSKY, PHILIPPE 1983-07-07 — — WO disclosed
WO-1983002277-A1 DNA FRAGMENTS MARKED AT LEAST AT ONE OF THE ENDS THEREOF BY MODIFIED RIBONUCLEOTIDES RECOGNIZABLE BY RELATED MOLECULES AND METHOD FOR ANALYZING SUCH DNA FRAGMENTS KOURILSKY, PHILIPPE 1983-07-07 — — WO disclosed
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