Paroxetine

Paroxetine

SCHEMBL9398356

Cl.Fc1ccc([C@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC6A4

The experimentally established mechanism targets of Paroxetine. 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
SLC6A4 known ✓ P31645 3/20 0.98
CYP3A4 P08684 4/20 1.00
MEN1 O00255 3/20 1.00
KMT2A Q03164 3/20 1.00
USP2 O75604 1/20 1.00
GRK2 P25098 4/20 0.98
TP53 P04637 2/20 0.98
CYP1A2 P05177 2/20 0.98
CYP2D6 P10635 2/20 0.98
ABCB11 O95342 1/20 0.98
LMNA P02545 1/20 0.98
NFKB1 P19838 1/20 0.98
MAPK1 P28482 1/20 0.98
THPO P40225 1/20 0.98
PMP22 Q01453 1/20 0.98
SMN1; SMN2 Q16637 1/20 0.98
ALDH1A1 P00352 1/20 0.98
CYP2C9 P11712 1/20 0.98
HSD17B10 Q99714 1/20 0.98
NPC1 O15118 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
Paroxetine SCHEMBL9398351 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2AUSP2GRK2
Paroxetine SCHEMBL2847926 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2AUSP2GRK2
Paroxetine SCHEMBL6100418 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2AUSP2GRK2
Paroxetine SCHEMBL29437926 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2AUSP2GRK2
Paroxetine SCHEMBL5312626 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2AUSP2GRK2
Paroxetine SCHEMBL33348 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2AUSP2GRK2
Paroxetine SCHEMBL3854638 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2AUSP2GRK2
Paroxetine SCHEMBL145268 0.99 CYP3A4 (1.00) CYP3A4MEN1KMT2AUSP2GRK2
Paroxetine SCHEMBL8184989 0.99 CYP3A4 (0.98) CYP3A4MEN1KMT2AUSP2GRK2
Paroxetine SCHEMBL145267 0.99 CYP3A4 (1.00) CYP3A4MEN1KMT2AUSP2GRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0266574-B1 Piperidine compounds and their preparation and use NOVO NORDISK AS (DK) 1994-01-05 EP disclosed
US-5019582-A Preventing Calcium Overload In Brain Cells NOVO NORDISK A/S (DK) 1991-05-28 US disclosed
US-4985446-A CALCIUM OVERLOAD BLOCKERS IN BRAIN CELLS A/S FERROSAN (DK) 1991-01-15 US disclosed
US-4877799-A Method of treating calcium overload in brain cells of mammals A/S FERROSAN (DK) 1989-10-31 US disclosed
EP-0266574-A2 Piperidine compounds and their preparation and use NOVO NORDISK A/S (DK) 1988-05-11 EP disclosed