Doxercalciferol

Doxercalciferol

SCHEMBL285669

C=C1/C(=C\C=C2/CCC[C@]3(C)[C@@H]([C@H](C)/C=C/[C@H](C)C(C)C)CC[C@@H]23)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 Doxercalciferol. 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 9/20 1.00
▸ ADRA1A P35348 2/20 0.80
▸ ADORA3 P0DMS8 2/20 0.80
▸ SLC6A2 P23975 2/20 0.80
▸ NR1I2 O75469 1/20 0.80
▸ PGR P06401 1/20 0.80
▸ HTR1A P08908 1/20 0.80
▸ SLC6A4 P31645 1/20 0.80
▸ PTGS2 P35354 1/20 0.80
▸ LMNA P02545 2/20 0.77
▸ AR P10275 1/20 0.77
▸ ALDH1A1 P00352 1/20 0.77
▸ ALOX15 P16050 1/20 0.77
▸ TSHR P16473 1/20 0.77
▸ CYP2C9 P11712 1/20 0.77
▸ CYP2C19 P33261 1/20 0.77
▸ CYP3A4 P08684 1/20 0.77
▸ USP2 O75604 1/20 0.77
▸ ABCB11 O95342 1/20 0.77
▸ ESR1 P03372 1/20 0.77

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
Doxercalciferol SCHEMBL7152665 1.00 VDR (1.00) VDRADRA1AADORA3SLC6A2NR1I2
Doxercalciferol SCHEMBL322422 1.00 VDR (1.00) VDRADRA1AADORA3SLC6A2NR1I2
Doxercalciferol SCHEMBL10337669 1.00 VDR (1.00) VDRADRA1AADORA3SLC6A2NR1I2
Doxercalciferol SCHEMBL15262963 1.00 VDR (1.00) VDRADRA1AADORA3SLC6A2NR1I2
Doxercalciferol SCHEMBL10018929 1.00 VDR (1.00) VDRADRA1AADORA3SLC6A2NR1I2
Doxercalciferol SCHEMBL3999503 1.00 VDR (1.00) VDRADRA1AADORA3SLC6A2NR1I2
Doxercalciferol SCHEMBL24066841 1.00 VDR (1.00) VDRADRA1AADORA3SLC6A2NR1I2
Doxercalciferol SCHEMBL9051060 1.00 VDR (1.00) VDRADRA1AADORA3SLC6A2NR1I2
Doxercalciferol SCHEMBL21433257 1.00 VDR (1.00) VDRADRA1AADORA3SLC6A2NR1I2
Doxercalciferol SCHEMBL9980508 1.00 VDR (1.00) VDRADRA1AADORA3SLC6A2NR1I2

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 140 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114755323-A Method and kit for detecting content of fat-soluble vitamins in dried blood paper 北京和合医学诊断技术股份有限公司 2022-07-15 — — CN claimed
CN-114460314-B Multivitamin D analogue detection kit and detection method 普迈德(北京)科技有限公司 2022-06-24 — — CN claimed
CN-114460314-A Detection kit and detection method for multivitamin D analogues 普迈德(北京)科技有限公司 2022-05-10 — — CN claimed
CN-113655132-A Method and kit for detecting content of 25 hydroxy vitamin D in human serum 艾可泰科生物科技(江苏)有限公司 2021-11-16 — — CN claimed
CN-113189237-A Analysis method for evaluating matrix effect of endogenous serum compounds 重庆黄嘉同怡科技有限公司 2021-07-30 — — CN claimed
EP-2633325-B1 LC-MS SEPARATION AND DETECTION OF VITAMIN D METABOLITES COHESIVE TECH INC (US) 2016-12-28 — — EP claimed
EP-2948474-A1 METHOD AND KIT FOR DETECTING 1,25-DIHYDROXYVITAMIN D AND RELATED ANTIBODIES DiaSorin S.p.A. (IT) 2015-12-02 — — EP claimed
US-9063159-B2 LC-MS separation and detection of vitamin D metabolites COHESIVE TECHNOLOGIES INC. (US) 2015-06-23 — — US claimed
WO-2014114780-A1 METHOD AND KIT FOR DETECTING 1,25-DIHYDROXYVITAMIN D AND RELATED ANTIBODIES DIASORIN S.P.A. (IT) 2014-07-31 — — WO claimed
JP-2006519854-A — — 2006-08-31 — — JP claimed
WO-2005102355-A1 METHODS OF TREATING VARIOUS VITAMIN D METABOLISM CONDITIONS WITH 1α-HYDROXYVITAMIN D2 GENZYME CORPORATION (US) 2005-11-03 — — WO claimed
WO-2004080467-A2 METHOD OF TREATING AND PREVENTING HYPERPARATHYROIDISM WITH VITAMIN D2 OR D4 COMPOUNDS BONE CARE INTERNATIONAL, INC. (US) 2004-09-23 — — WO claimed
US-20030207847-A1 Dietary calcium as a supplement to vitamin D compound treatment of multiple sclerosis DELUCA HECTOR F (US) 2003-11-06 — — US claimed
US-20030022873-A1 Dietary calcium as a supplement to vitamin D compound treatment of multiple sclerosis DELUCA HECTOR F (US) 2003-01-30 — — US claimed
EP-1196174-A1 DIETARY CALCIUM AS A SUPPLEMENT TO VITAMIN D COMPOUND TREATMENT OF MULTIPLE SCLEROSIS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2002-04-17 — — EP claimed
US-20020016313-A1 DIETARY CALCIUM AS A SUPPLEMENT TO VITAMIN D COMPOUND TREATMENT OF MULTIPLE SCLEROSIS WISCONSIN ALUMNI RESEARCH FOUNDATION 2002-02-07 — — US claimed
WO-2001003704-A1 DIETARY CALCIUM AS A SUPPLEMENT TO VITAMIN D COMPOUND TREATMENT OF MULTIPLE SCLEROSIS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2001-01-18 — — WO claimed
EP-0398715-B1 Method of exterminating rodents and other vertebrate pests WISCONSIN ALUMNI RES FOUND (US) 1995-04-19 — — EP claimed
EP-0112332-B1 VITAMIN D GLYCOSIDES THE GENERAL HOSPITAL CORPORATION (US) 1993-06-16 — — EP claimed
EP-0398715-A2 Method of exterminating rodents and other vertebrate pests WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1990-11-22 — — EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030207847-A1 Dietary calcium as a supplement to vitamin D compound treatment of multiple sclerosis VDR, ORAI1, CYP24A1 VDR 1/4885ADRA1A 2898/4885ADORA3 605/4885
US-20020016313-A1 DIETARY CALCIUM AS A SUPPLEMENT TO VITAMIN D COMPOUND TREATMENT OF MULTIPLE SCLEROSIS VDR, ORAI1, CYP24A1 VDR 1/4885ADRA1A 2898/4885ADORA3 605/4885
US-20030022873-A1 Dietary calcium as a supplement to vitamin D compound treatment of multiple sclerosis VDR, ORAI1, CYP24A1 VDR 1/4885ADRA1A 2898/4885ADORA3 605/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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