Calcitriol

Calcitriol

SCHEMBL39704

C=C1/C(=C\C=C2CCC[C@@]3(C)C2CC[C@@H]3[C@H](C)CCCC(C)(C)O)C[C@@H](O)CC1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

VDR

The experimentally established mechanism targets of Calcitriol. 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
VDR known ✓ P11473 10/20 1.00
MAPT P10636 3/20 1.00
ADORA3 P0DMS8 2/20 1.00
SLC6A2 P23975 2/20 1.00
AGTR1 P30556 2/20 1.00
SMN1; SMN2 Q16637 2/20 1.00
NR1I2 O75469 1/20 1.00
ABCB11 O95342 1/20 1.00
GC P02774 1/20 1.00
PGR P06401 1/20 1.00
RXRA P19793 1/20 1.00
CHRM3 P20309 1/20 1.00
CNR1 P21554 1/20 1.00
HTR2C P28335 1/20 1.00
MAPK1 P28482 1/20 1.00
SLC6A4 P31645 1/20 1.00
ADRA1A P35348 1/20 1.00
PTGS2 P35354 1/20 1.00
OPRD1 P41143 1/20 1.00
OPRK1 P41145 1/20 1.00

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
Calcitriol SCHEMBL3488822 1.00 VDR (1.00) VDRMAPTADORA3SLC6A2AGTR1
Calcitriol SCHEMBL2641696 1.00 VDR (1.00) VDRMAPTADORA3SLC6A2AGTR1
Calcitriol SCHEMBL2733051 1.00 VDR (1.00) VDRMAPTADORA3SLC6A2AGTR1
Calcitriol SCHEMBL15169024 1.00 VDR (1.00) VDRMAPTADORA3SLC6A2AGTR1
Calcitriol SCHEMBL24066838 1.00 VDR (1.00) VDRMAPTADORA3SLC6A2AGTR1
Calcitriol SCHEMBL14027727 1.00 VDR (1.00) VDRMAPTADORA3SLC6A2AGTR1
Calcitriol SCHEMBL23386523 1.00 VDR (1.00) VDRMAPTADORA3SLC6A2AGTR1
Calcitriol SCHEMBL13989116 1.00 VDR (1.00) VDRMAPTADORA3SLC6A2AGTR1
Calcitriol SCHEMBL17973736 1.00 VDR (1.00) VDRMAPTADORA3SLC6A2AGTR1
Calcitriol SCHEMBL21055106 1.00 VDR (1.00) VDRMAPTADORA3SLC6A2AGTR1

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

Appears in 7789 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260034149-A1 ENHANCED SALICYLIC ACID AND DRUG DELIVERY FOR AQUEOUS TOPICAL APPLICATIONS Otiko, Christopher Ayo (US) 2026-02-05 US claimed
EP-4647447-A2 BINDING PARTNERS SPECIFIC FOR VITAMIN D EPIMERS Siemens Healthcare Diagnostics, Inc. (US) 2025-11-12 EP claimed
US-12465567-B2 Enhanced antibiotic and drug delivery for aqueous topical applications for human and veterinary uses Otiko, Christopher Ayo (US) 2025-11-11 US claimed
US-20250228874-A1 CALCITRIOL OR CALCITRIOL ANALOGUES FOR TREATING PERIPERHAL NEUROPATHIC PAIN DISORDERS EPTIVA THERAPEUTICS LTD. (GB) 2025-07-17 US claimed
US-12343421-B2 Vitamin D base layer Solaana MD LLC (US) 2025-07-01 US claimed
EP-4573188-A1 OXIDATION OF STEROIDS Oxford University Innovation Limited (GB) 2025-06-25 EP claimed
WO-2025108575-A1 METHODS OF SELECTIVE DEPROTECTION AND SYNTHESIS OF TRANSHYDRINDANE- SKELETON-BASED COMPOUNDS ROCHE DIAGNOSTICS GMBH (DE) 2025-05-30 WO claimed
US-20240392280-A1 PRODUCTS AND METHODS FOR ASSESSING AND INCREASING KLOTHO PROTEIN LEVELS KLOTHO THERAPEUTICS, INC. 2024-11-28 US claimed
CN-116369527-B Bifidobacterium breve capable of regulating bone development and application thereof 江南大学 2024-07-30 CN claimed
EP-4379384-A2 COMPOSITIONS, DEVICES, AND METHODS OF MITIGATING LIPOPROTEIN INTERFERENCE IN IN VITRO DIAGNOSTIC ASSAYS FOR HYDROPHOBIC ANALYTES Siemens Healthcare Diagnostics Inc. (US) 2024-06-05 EP claimed
WO-1990006121-A2 METHOD FOR IMPROVING REPRODUCTIVE FUNCTIONS IN MAMMALS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1990-06-14 WO claimed
EP-0301167-A1 A combination of cholecalciferol derivatives for the treatment of renal bone disease Teva Pharmaceutical Industries Limited (IL) 1989-02-01 EP claimed
EP-0202276-A4 COMPOSITION FOR THE TREATMENT OF PSORIASIS. GEN HOSPITAL CORP (US) 1988-09-28 EP claimed
EP-0202276-A1 COMPOSITION FOR THE TREATMENT OF PSORIASIS. GEN HOSPITAL CORP (US) 1986-11-26 EP claimed
WO-1986002527-A1 METHOD OF TREATING PSORIASIS THE GENERAL HOSPITAL CORPORATION (US) 1986-05-09 WO claimed
EP-0042673-B1 CYTORECEPTOR ASSAY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1986-03-26 EP claimed
EP-0042673-A1 Cytoreceptor assay THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1981-12-30 EP claimed
US-4225596-A Method for treating calcium imbalance and improving calcium absorption in mammals WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1980-09-30 US claimed
US-4110446-A METHOD OF TREATING MILK FEVER IN DAIRY CATTLE WITH 1,25-DIHYDROXYCHOLECALCIFEROL WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1978-08-29 US claimed
US-4035493-A Rodenticide WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1977-07-12 US claimed