Methylatropine

Methylatropine

SCHEMBL29389879

C[N+]1(C)[C@@H]2CC[C@H]1CC(OC(=O)[C@@H](CO)c1ccccc1)C2.[I-]

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNG

The experimentally established mechanism targets of Methylatropine. 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
CHRM1 known ✓ P11229 6/20 0.78
CHRM3 known ✓ P20309 5/20 0.78
PABPC1 P11940 2/20 1.00
CHRM2 P08172 7/20 0.97
BLM P54132 4/20 0.95
SMN1; SMN2 Q16637 2/20 0.87
CYP2C19 P33261 1/20 0.80
CHRM5 P08912 5/20 0.78
CHRM4 P08173 4/20 0.78
MEN1 O00255 3/20 0.78
KMT2A Q03164 3/20 0.78
TSHR P16473 2/20 0.78
CYP3A4 P08684 1/20 0.71
CYP2C9 P11712 1/20 0.71
HIF1A Q16665 1/20 0.71
HSD17B10 Q99714 1/20 0.71
KDM4E B2RXH2 1/20 0.66
LMNA P02545 1/20 0.66
POLB P06746 1/20 0.66
ADRA2C P18825 1/20 0.66

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
Methylatropine SCHEMBL34463463 0.99 CHRM2 (1.00) PABPC1CHRM2BLMSMN1; SMN2CYP2C19
Methylatropine SCHEMBL824874 0.99 CHRM2 (1.00) PABPC1CHRM2BLMSMN1; SMN2CYP2C19
Methylatropine SCHEMBL30647266 0.97 BLM (1.00) PABPC1CHRM2BLMSMN1; SMN2CYP2C19
Methylatropine SCHEMBL1321572 0.97 BLM (1.00) PABPC1CHRM2BLMSMN1; SMN2CYP2C19
Methylatropine SCHEMBL20798247 0.93 SMN1; SMN2 (1.00) PABPC1CHRM2BLMSMN1; SMN2CYP2C19
Methylatropine SCHEMBL56394 0.93 SMN1; SMN2 (1.00) PABPC1CHRM2BLMSMN1; SMN2CYP2C19
Methylatropine SCHEMBL30003811 0.93 SMN1; SMN2 (1.00) PABPC1CHRM2BLMSMN1; SMN2CYP2C19
Ipratropium SCHEMBL3301405 0.89 CHRM2 (0.98) PABPC1CHRM2BLMSMN1; SMN2CYP2C19
Atropine Oxide SCHEMBL98985 0.89 CYP2C19 (1.00) PABPC1CHRM2BLMSMN1; SMN2CYP2C19
Atropine Oxide SCHEMBL29369999 0.89 CYP2C19 (1.00) PABPC1CHRM2BLMSMN1; SMN2CYP2C19

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
US-11246873-B2 Directed differentiation of oligodendrocyte precursor cells to a myelinating cell fate THE SCRIPPS RESEARCH INSTITUTE (US) 2022-02-15 US disclosed