Strychnine

Strychnine

SCHEMBL15475787

CI.O=C1C[C@@H]2OCC=C3CN4CC[C@]56c7ccccc7N1[C@H]5[C@H]2[C@H]3C[C@H]46

nearest known ligand 0.95

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Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GLRA1 P23415 14/20 0.95
GLRB P48167 14/20 0.95
CYP3A4 P08684 2/20 0.95
TAS2R10 Q9NYW0 2/20 0.95
MEN1 O00255 2/20 0.95
KMT2A Q03164 2/20 0.95
SCN1A P35498 1/20 0.95
TAS2R46 P59540 1/20 0.95
SCN2A Q99250 1/20 0.95
SCN3A Q9NY46 1/20 0.95
CHRM1 P11229 1/20 0.70
SMN1; SMN2 Q16637 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
Strychnine SCHEMBL21985190 0.97 GLRA1 (1.00) GLRA1GLRBCYP3A4TAS2R10MEN1
Strychnine SCHEMBL14047653 0.97 GLRA1 (1.00) GLRA1GLRBCYP3A4TAS2R10MEN1
Strychnine SCHEMBL29352583 0.97 GLRA1 (1.00) GLRA1GLRBCYP3A4TAS2R10MEN1
Strychnine SCHEMBL29362678 0.97 GLRA1 (1.00) GLRA1GLRBCYP3A4TAS2R10MEN1
Strychnine SCHEMBL12549549 0.97 GLRA1 (1.00) GLRA1GLRBCYP3A4TAS2R10MEN1
Strychnine SCHEMBL14117483 0.97 GLRA1 (1.00) GLRA1GLRBCYP3A4TAS2R10MEN1
Strychnine SCHEMBL14029424 0.97 GLRA1 (1.00) GLRA1GLRBCYP3A4TAS2R10MEN1
Strychnine SCHEMBL93798 0.97 GLRA1 (1.00) GLRA1GLRBCYP3A4TAS2R10MEN1
Strychnine SCHEMBL25300604 0.96 GLRA1 (0.98) GLRA1GLRBCYP3A4TAS2R10MEN1
Strychnine SCHEMBL31047368 0.96 GLRA1 (0.98) GLRA1GLRBCYP3A4TAS2R10MEN1

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-20180042899-A1 Method of Treating Transplant Rejection and Autoimmune Diseases NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2018-02-15 US disclosed
US-20140050694-A1 Method of Treating Transplant Rejection and Autoimmune Diseases WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2014-02-20 US disclosed