Trabodenoson

Trabodenoson

SCHEMBL14829316

O=[N+]([O-])OCC1OC(n2cnc3c(NC4CCCC4)ncnc32)C(O)C1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 known ✓ P30542 10/20 1.00
ADORA3 P0DMS8 8/20 1.00
ADORA2A P29274 5/20 1.00
ADORA2B P29275 4/20 1.00
TAS1R3 Q7RTX0 1/20 0.73
TAS1R1 Q7RTX1 1/20 0.73
TSHR P16473 2/20 0.72
PMP22 Q01453 2/20 0.72
GAA P10253 1/20 0.72
HTT P42858 1/20 0.72
SIGMAR1 Q99720 1/20 0.72
SLC29A1 Q99808 1/20 0.72
RXFP1 Q9HBX9 1/20 0.72
MEN1 O00255 1/20 0.72
KMT2A Q03164 1/20 0.72
TP53 P04637 1/20 0.72
NFKB1 P19838 1/20 0.72
HIF1A Q16665 1/20 0.72
SMN1; SMN2 Q16637 1/20 0.70
TDP1 Q9NUW8 1/20 0.70

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
Trabodenoson SCHEMBL15183438 1.00 ADORA1 (1.00) ADORA1ADORA3ADORA2AADORA2BTAS1R3
Trabodenoson SCHEMBL121828 1.00 ADORA1 (1.00) ADORA1ADORA3ADORA2AADORA2BTAS1R3
Trabodenoson SCHEMBL29359454 1.00 ADORA1 (1.00) ADORA1ADORA3ADORA2AADORA2BTAS1R3
Trabodenoson SCHEMBL17513019 1.00 ADORA1 (1.00) ADORA1ADORA3ADORA2AADORA2BTAS1R3
SCHEMBL124574 0.99 ADORA1 (1.00) ADORA1ADORA3ADORA2AADORA2BTAS1R3
SCHEMBL121829 0.93 ADORA1 (0.86) ADORA1ADORA3ADORA2AADORA2BTAS1R3
SCHEMBL2488256 0.93 ADORA1 (0.86) ADORA1ADORA3ADORA2AADORA2BTAS1R3
SCHEMBL124575 0.92 ADORA1 (0.87) ADORA1ADORA3ADORA2AADORA2BTAS1R3
SCHEMBL17207180 0.92 ADORA1 (0.85) ADORA1ADORA3ADORA2AADORA2BTAS1R3
SCHEMBL6745875 0.91 ADORA1 (0.82) ADORA1ADORA3ADORA2AADORA2BTAS1R3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013049725-A2 METHODS OF USING ADENOSINE A1 RECEPTOR ACTIVATION FOR TREATING DEPRESSION TUFTS UNIVERSITY (US) 2013-04-04 WO claimed
US-20140241990-A1 METHODS OF USING ADENOSINE A1 RECEPTOR ACTIVATION FOR TREATING DEPRESSION TUFTS UNIVERSITY (US) 2014-08-28 US disclosed
WO-2013049725-A2 METHODS OF USING ADENOSINE A1 RECEPTOR ACTIVATION FOR TREATING DEPRESSION TUFTS UNIVERSITY (US) 2013-04-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140241990-A1 METHODS OF USING ADENOSINE A1 RECEPTOR ACTIVATION FOR TREATING DEPRESSION ADORA2A, ADORA1, ADORA3 ADORA1 2/4885ADORA3 3/4885ADORA2A 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.