Oxybutynin

Oxybutynin

SCHEMBL4606219

CCN(CC)CC#CCOC(=O)C(O)(c1ccccc1)C1CCCCC1.N

nearest known ligand 0.98

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CHRM2CHRM3

The experimentally established mechanism targets of Oxybutynin. 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
CHRM2 known ✓ P08172 6/20 0.98
CHRM3 known ✓ P20309 4/20 0.98
CHRM1 P11229 6/20 0.98
CHRM4 P08173 4/20 0.98
KCNH2 Q12809 3/20 0.98
CYP2C19 P33261 2/20 0.98
SLC6A3 Q01959 2/20 0.98
CYP3A4 P08684 2/20 0.98
CYP1A2 P05177 1/20 0.98
CYP2D6 P10635 1/20 0.98
CYP2C9 P11712 1/20 0.98
PKM P14618 1/20 0.98
NFKB1 P19838 1/20 0.98
THPO P40225 1/20 0.98
ABCB11 O95342 1/20 0.98
ESR1 P03372 1/20 0.98
CHRM5 P08912 1/20 0.98
ADRA2A P08913 1/20 0.98
ADORA3 P0DMS8 1/20 0.98
TBXA2R P21731 1/20 0.98

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
Oxybutynin SCHEMBL1560964 0.99 CHRM2 (1.00) CHRM2CHRM1CHRM4CHRM3KCNH2
Oxybutynin SCHEMBL2992 0.99 CHRM2 (1.00) CHRM2CHRM1CHRM4CHRM3KCNH2
Esoxybutynin SCHEMBL290373 0.99 CHRM2 (1.00) CHRM2CHRM1CHRM4CHRM3KCNH2
Aroxybutynin SCHEMBL25880 0.99 CHRM2 (1.00) CHRM2CHRM1CHRM4CHRM3KCNH2
Oxybutynin SCHEMBL25751 0.98 MEN1 (1.00) CHRM2CHRM1CHRM4CHRM3KCNH2
Oxybutynin SCHEMBL8019436 0.98 MEN1 (1.00) CHRM2CHRM1CHRM4CHRM3KCNH2
Oxybutynin SCHEMBL19816026 0.98 CHRM2 (0.98) CHRM2CHRM1CHRM4CHRM3KCNH2
Oxybutynin SCHEMBL7895841 0.98 CHRM2 (0.98) CHRM2CHRM1CHRM4CHRM3KCNH2
Oxybutynin SCHEMBL5494388 0.98 MEN1 (1.00) CHRM2CHRM1CHRM4CHRM3KCNH2
Oxybutynin SCHEMBL7557853 0.98 CHRM2 (0.98) CHRM2CHRM1CHRM4CHRM3KCNH2

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
EP-1435915-B1 ORAL DOSAGE FORMS FOR PROPIVERINE OR ITS PHARMACEUTICALLY ACCEPTABLE SALTS WITH AN EXTENDED RELEASE OF THE ACTIVE INGREDIENT APOGEPHA ARZNEIMITTEL GMBH (DE) 2008-07-23 EP disclosed
EP-1435915-A1 ORAL DOSAGE FORM FOR PROPIVERINE OR ITS PHARMACEUTICALLY ACCEPTABLE SALTS WITH AN EXTENDED RELEASE OF THE ACTIVE INGREDIENT APOGEPHA ARZNEIMITTEL GmbH (DE) 2004-07-14 EP disclosed
WO-2003030869-A1 ORAL DOSAGE FORM FOR PROPIVERINE OR ITS PHARMACEUTICALLY ACCEPTABLE SALTS WITH AN EXTENDED RELEASE OF THE ACTIVE INGREDIENT APOGEPHA ARZNEIMITTEL GMBH (DE) 2003-04-17 WO disclosed