Pyrimidine

Pyrimidine

SCHEMBL28042274

O=C1Cc2ccccc2N1Cc1ccccc1.c1cncnc1

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.60
KMT2A Q03164 8/20 0.55
MEN1 O00255 7/20 0.55
MAPT P10636 3/20 0.55
ALDH1A1 P00352 2/20 0.55
APAF1 O14727 1/20 0.55
HPGD P15428 1/20 0.55
HTR1A P08908 2/20 0.50
DRD2 P14416 2/20 0.48
DRD4 P21917 1/20 0.48
OPRM1 P35372 1/20 0.47
OPRK1 P41145 1/20 0.47
OPRL1 P41146 1/20 0.47
CYP1A2 P05177 1/20 0.46
GAA P10253 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
GSK3A P49840 1/20 0.45
GSK3B P49841 1/20 0.45

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
SCHEMBL578257 0.89 POLB (0.73) POLBKMT2AMEN1MAPTALDH1A1
SCHEMBL30597487 0.89 POLB (0.73) POLBKMT2AMEN1MAPTALDH1A1
SCHEMBL24270340 0.78 KMT2A (0.72) POLBKMT2AMEN1MAPTALDH1A1
SCHEMBL496680 0.76 POLB (0.61) POLBKMT2AMEN1MAPTALDH1A1
SCHEMBL29637973 0.76 POLB (0.61) POLBKMT2AMEN1MAPTALDH1A1
SCHEMBL15207803 0.76 CYP11B1 (0.58) POLBMAPTALDH1A1CYP1A2CYP2C9
SCHEMBL5807332 0.75 KMT2A (0.59) POLBKMT2AMEN1MAPTALDH1A1
SCHEMBL29880432 0.75 POLB (1.00) POLBKMT2AMEN1MAPTALDH1A1
SCHEMBL10688767 0.75 POLB (1.00) POLBKMT2AMEN1MAPTALDH1A1
SCHEMBL9541791 0.74 MDH2 (0.58) POLBKMT2AMEN1MAPTALDH1A1

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-105143463-A Novel androgen receptor mutation NOVARTIS AG 2015-12-09 CN disclosed