Tacalcitol

Tacalcitol

SCHEMBL3278786

C=C1/C(=C\C=C2CCC[C@@]3(C)C2CC[C@@H]3[C@H](C)CC[C@@H](O)C(C)C)C[C@@H](O)C[C@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VDR P11473 11/20 1.00
ADORA3 P0DMS8 3/20 0.80
SLC6A2 P23975 3/20 0.80
AGTR1 P30556 2/20 0.80
MAPT P10636 2/20 0.76
NR1I2 O75469 2/20 0.76
PGR P06401 2/20 0.76
SLC6A4 P31645 2/20 0.76
ADRA1A P35348 2/20 0.76
PTGS2 P35354 2/20 0.76
ABCB11 O95342 1/20 0.76
GC P02774 1/20 0.76
RXRA P19793 1/20 0.76
CHRM3 P20309 1/20 0.76
CNR1 P21554 1/20 0.76
HTR2C P28335 1/20 0.76
MAPK1 P28482 1/20 0.76
OPRD1 P41143 1/20 0.76
OPRK1 P41145 1/20 0.76
SLC6A3 Q01959 1/20 0.76

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
Tacalcitol SCHEMBL5082357 1.00 VDR (1.00) VDRADORA3SLC6A2AGTR1MAPT
Tacalcitol SCHEMBL6932330 1.00 VDR (1.00) VDRADORA3SLC6A2AGTR1MAPT
Tacalcitol SCHEMBL5433654 1.00 VDR (1.00) VDRADORA3SLC6A2AGTR1MAPT
Tacalcitol SCHEMBL3609295 1.00 VDR (1.00) VDRADORA3SLC6A2AGTR1MAPT
Tacalcitol SCHEMBL5444609 1.00 VDR (1.00) VDRADORA3SLC6A2AGTR1MAPT
Tacalcitol SCHEMBL24066858 1.00 VDR (1.00) VDRADORA3SLC6A2AGTR1MAPT
Tacalcitol SCHEMBL3278784 1.00 VDR (1.00) VDRADORA3SLC6A2AGTR1MAPT
Tacalcitol SCHEMBL2130976 1.00 VDR (1.00) VDRADORA3SLC6A2AGTR1MAPT
Tacalcitol SCHEMBL21836181 1.00 VDR (1.00) VDRADORA3SLC6A2AGTR1MAPT
Tacalcitol SCHEMBL5444615 1.00 VDR (1.00) VDRADORA3SLC6A2AGTR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1165061-B1 USE OF COMPOUND PREPARATION MADE OF VITAMIN D METABOLITES OR VITAMIN D ANALOGUES AND PARTIAL ESTROGEN AGONISTS FOR TREATING OSTEOPOROSIS SCHERING AG (DE) 2005-10-19 EP claimed
EP-0567352-B1 Use of 1-alpha,24(R)-dihydroxy-22(E)-dehydro-vitamin D3 for the manufacture of a medicament for the treatment of osteoporosis WISCONSIN ALUMNI RES FOUND (US) 1996-03-13 EP claimed
EP-0567352-A1 Use of 1-alpha,24(R)-dihydroxy-22(E)-dehydro-vitamin D3 for the manufacture of a medicament for the treatment of osteoporosis WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1993-10-27 EP claimed
EP-0177920-B1 PHARMACEUTICAL COMPOSITION FOR EXTERNAL USE CONTAINING ACTIVE TYPE VITAM D3 TEIJIN LIMITED (JP) 1990-09-12 EP claimed
US-4594340-A Antitumor agent HOFFMANN-LA ROCHE INC. (US) 1986-06-10 US claimed
US-4364941-A ANALOGS OF VITAMIN D3 TEIJIN LIMITED (JP) 1982-12-21 US claimed
US-4305935-A VITAMIN D3 DERIVATIVE AND ACETYLSALICYLIC ACID USEFUL AGAINST THE DISEASES CAUSED BY VITAMIN D DEFICIENCY TEIJIN LIMITED (JP) 1981-12-15 US claimed
US-4022891-A Novel 1α,24-dihydroxycholecalciferol compositions, novel precursors thereof, and processes for preparing them TEIJIN LIMITED (JA) 1977-05-10 US claimed
JP-62026223-A None JP disclosed
JP-7196515-A None JP disclosed
JP-6024992-A None JP disclosed
JP-7196514-A None JP disclosed
JP-59186956-A None JP disclosed
JP-7242550-A None JP disclosed
EP-0177920-A2 Pharmaceutical composition for external use containing active type vitam D3 TEIJIN LIMITED (JP) 1986-04-16 EP disclosed
EP-0081793-B1 NOVEL VITAMIN D3 DERIVATIVES AND PROCESS FOR PRODUCING THE SAME Chugai Seiyaku Kabushiki Kaisha (JP) 1986-04-09 EP disclosed
JP-S59186956-A 24-HYDROXY-25-DEHYDROVITAMIN D3, ITS PRODUCTION AND CALCIUM REGULATING AGENT CONTAINING THE SAME AS ACTIVE CONSTITUENT TEIJIN LTD 1984-10-23 JP disclosed
US-4341774-A Method for suppressing abnormal rise in immunological function and agent useful therefor CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 1982-07-27 US disclosed
US-4305935-A VITAMIN D3 DERIVATIVE AND ACETYLSALICYLIC ACID USEFUL AGAINST THE DISEASES CAUSED BY VITAMIN D DEFICIENCY TEIJIN LIMITED (JP) 1981-12-15 US disclosed
US-4022891-A Novel 1α,24-dihydroxycholecalciferol compositions, novel precursors thereof, and processes for preparing them TEIJIN LIMITED (JA) 1977-05-10 US disclosed