SCHEMBL9805175

SCHEMBL9805175

Nc1ncnc2c1ncn2[C@@H]1O[C@H](COC(=O)[C@@H](N)CN(O)N=O)[C@@H](O)[C@H]1O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MARS1 P56192 1/20 0.69
▸ PLA2G2A P14555 1/20 0.59
▸ P2RY1 P47900 3/20 0.59
▸ ADORA1 P30542 2/20 0.59
▸ SRC P12931 2/20 0.59
▸ P2RY2 P41231 2/20 0.59
▸ DNPH1 O43598 1/20 0.59
▸ PRKAB2 O43741 1/20 0.59
▸ TRPM2 O94759 1/20 0.59
▸ LDHA P00338 1/20 0.59
▸ ADRB2 P07550 1/20 0.59
▸ FBP1 P09467 1/20 0.59
▸ PRKAG1 P54619 1/20 0.59
▸ PRKAA2 P54646 1/20 0.59
▸ PDE4D Q08499 1/20 0.59
▸ KCNH2 Q12809 1/20 0.59
▸ PRKAA1 Q13131 1/20 0.59
▸ PDE3A Q14432 1/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ TAS1R3 Q7RTX0 1/20 0.59

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
Adenosine SCHEMBL9805161 0.87 DOT1L (0.68) ADORA1SMN1; SMN2EHMT2NNMTADORA3
SCHEMBL1858296 0.85 MARS1 (0.75) MARS1PLA2G2AP2RY1ADORA1SRC
SCHEMBL6408975 0.85 MARS1 (0.80) MARS1P2RY1ADORA1SRCP2RY2
SCHEMBL6408983 0.85 MARS1 (0.80) MARS1P2RY1ADORA1SRCP2RY2
SCHEMBL2761284 0.82 MARS1 (0.74) MARS1PLA2G2AP2RY1ADORA1SRC
SCHEMBL7757016 0.82 MARS1 (0.73) MARS1P2RY1ADORA1SRCP2RY2
SCHEMBL3014292 0.82 MARS1 (1.00) MARS1EHMT2NNMTNSD2PCMT1
SCHEMBL583457 0.82 MARS1 (1.00) MARS1EHMT2NNMTNSD2PCMT1
SCHEMBL8846496 0.82 MARS1 (0.73) MARS1PLA2G2AP2RY1ADORA1SRC
SCHEMBL2463542 0.81 PRKACA (0.73) MARS1P2RY1ADORA1SRCP2RY2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5043270-A Genetic engineering to produce polypeptide drugs, amplification THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 1991-08-27 — — US disclosed
WO-1990012025-A1 INTRONIC OVEREXPRESSION VECTORS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 1990-10-18 — — WO disclosed
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