Ercalcitriol

Ercalcitriol

SCHEMBL17274137

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nearest known ligand 0.80

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VDR P11473 12/20 0.80
ADORA3 P0DMS8 3/20 0.78
SLC6A2 P23975 3/20 0.78
NR1I2 O75469 2/20 0.78
PGR P06401 2/20 0.78
SLC6A4 P31645 2/20 0.78
ADRA1A P35348 2/20 0.78
PTGS2 P35354 2/20 0.78
HTR1A P08908 1/20 0.78
MAPT P10636 2/20 0.71
AGTR1 P30556 2/20 0.71
ABCB11 O95342 1/20 0.71
GC P02774 1/20 0.71
RXRA P19793 1/20 0.71
CHRM3 P20309 1/20 0.71
CNR1 P21554 1/20 0.71
HTR2C P28335 1/20 0.71
MAPK1 P28482 1/20 0.71
OPRD1 P41143 1/20 0.71
OPRK1 P41145 1/20 0.71

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
Ercalcitriol SCHEMBL12922723 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR
Ercalcitriol SCHEMBL17274136 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR
Ercalcitriol SCHEMBL4393978 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR
Ercalcitriol SCHEMBL264876 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR
Ercalcitriol SCHEMBL264875 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR
Ercalcitriol SCHEMBL4398182 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR
Ercalcitriol SCHEMBL23142603 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR
Ercalcitriol SCHEMBL8776000 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR
Ercalcitriol SCHEMBL9050396 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR
Ercalcitriol SCHEMBL21433255 1.00 VDR (0.80) VDRADORA3SLC6A2NR1I2PGR

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-20150335662-A1 METHODS FOR DIAGNOSING AND TREATING SEPSIS LOMA LINDA UNIVERSITY 2015-11-26 US disclosed