SCHEMBL6065982

SCHEMBL6065982

Nc1ncnc2c1nc(Br)n2OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 12/20 0.48
ADORA2B P29275 12/20 0.48
ADORA1 P30542 12/20 0.48
ADORA3 P0DMS8 7/20 0.46
ENPP1 P22413 2/20 0.42
ENPP3 O14638 1/20 0.42

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
SCHEMBL446004 0.85 ENPP1 (0.42) ENPP1ENPP3
SCHEMBL1035726 0.76 ENPP1 (0.51) ENPP1ENPP3
SCHEMBL502621 0.75 ENPP1 (0.52) ENPP1ENPP3
SCHEMBL8509835 0.75 ENPP1 (0.50) ADORA1ENPP1ENPP3
SCHEMBL8628968 0.71 NADK (0.64)
SCHEMBL4314233 0.71 ENTPD1 (0.72)
SCHEMBL21065572 0.69 LMNA (0.47) ADORA2AADORA2BADORA1ENPP1
SCHEMBL23679559 0.69 ADORA2A (0.64) ADORA2AADORA2BADORA1ADORA3
SCHEMBL10379475 0.68 ADORA2A (0.68) ADORA2AADORA2BADORA1ADORA3
SCHEMBL27721221 0.68 FGFR1 (0.47) ADORA2AADORA1ENPP1ENPP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1711626-A2 NUCLEIC ACID SEQUENCING BY RAMAN MONITORING OF UPTAKE OF NUCLEOTIDES DURING MOLECULAR REPLICATION INTEL CORPORATION (US) 2006-10-18 EP disclosed
US-20050202468-A1 Nucleic acid sequencing by Raman monitoring of uptake of nucleotides during molecular replication INTEL CORPORATION 2005-09-15 US disclosed
WO-2005066369-A2 NUCLEIC ACID SEQUENCING BY RAMAN MONITORING OF UPTAKE OF NUCLEOTIDES DURING MOLECULAR REPLICATION INTEL CORPORATION (US) 2005-07-21 WO disclosed
US-20050147979-A1 Nucleic acid sequencing by Raman monitoring of uptake of nucleotides during molecular replication INTEL CORPORATION (US) 2005-07-07 US disclosed