Ritanserin

Ritanserin

SCHEMBL11084334

Cc1nc2sccn2c(=O)c1CCN1CCC(=C(c2ccc(F)cc2)c2ccc(F)cc2)CC1.O=P(O)(O)O.O=P(O)(O)O

nearest known ligand 0.93

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Ritanserin. 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
OPRM1 known ✓ P35372 2/20 0.93
ADRB2 known ✓ P07550 1/20 0.93
ADRA1A known ✓ P35348 1/20 0.93
HRH1 known ✓ P35367 1/20 0.93
ADRA1B known ✓ P35368 1/20 0.93
OPRK1 known ✓ P41145 1/20 0.93
OPRD1 known ✓ P41143 1/20 0.38
MAPT P10636 4/20 0.93
CYP2D6 P10635 3/20 0.93
TSHR P16473 3/20 0.93
DGKA P23743 3/20 0.93
PKM P14618 3/20 0.93
HTR1A P08908 3/20 0.93
ALDH1A1 P00352 2/20 0.93
LMNA P02545 2/20 0.93
TP53 P04637 2/20 0.93
CYP2C9 P11712 2/20 0.93
ALOX15 P16050 2/20 0.93
HSD17B10 Q99714 2/20 0.93
TDP1 Q9NUW8 2/20 0.93

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
Ritanserin SCHEMBL11084340 1.00 MAPT (0.93) MAPTCYP2D6TSHRDGKAPKM
Ritanserin SCHEMBL49227 0.96 MAPT (1.00) MAPTCYP2D6TSHRDGKAPKM
Ritanserin SCHEMBL10598671 0.95 MAPT (0.98) MAPTCYP2D6TSHRDGKAPKM
SCHEMBL316891 0.93 MAPT (1.00) MAPTCYP2D6TSHRDGKAPKM
Hydrochloric Acid SCHEMBL10598175 0.92 MAPT (0.98) MAPTCYP2D6TSHRDGKAPKM
Ritanserin SCHEMBL11034762 0.91 MAPT (0.90) MAPTCYP2D6TSHRDGKAPKM
Ritanserin SCHEMBL10842786 0.91 MAPT (0.88) MAPTCYP2D6TSHRDGKAPKM
Hydrochloric Acid SCHEMBL10845530 0.90 MAPT (0.87) MAPTCYP2D6TSHRDGKAPKM
Ritanserin SCHEMBL8430142 0.82 MAPT (0.73) MAPTCYP2D6TSHRDGKAPKM
SCHEMBL10919317 0.81 HTR2C (0.73) MAPTCYP2D6TSHRDGKAPKM

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-4485107-A SEDATIVES, MUSCLE RELAXANTS JANSSEN PHARMACEUTICA N.V. (BE) 1984-11-27 US disclosed