Sugi Predict

Sugi Predict / Compounds / Epicoprosterol

Epicoprosterol

Epicoprosterol

SCHEMBL6519923

CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4CCCC(O)[C@]4(C)[C@H]3CC[C@]12C.CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.66

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2C19 P33261 2/20 0.66
▸ CYP2D6 P10635 1/20 0.66
▸ OSBP P22059 1/20 0.65
▸ OSBP2 Q969R2 1/20 0.65
▸ INPP5D Q92835 1/20 0.64
▸ ST6GAL1 P15907 2/20 0.63
▸ GPBAR1 Q8TDU6 5/20 0.61
▸ CASP7 P55210 3/20 0.61
▸ HIF1A Q16665 3/20 0.61
▸ TP53 P04637 2/20 0.61
▸ MAPK1 P28482 2/20 0.61
▸ HSD17B10 Q99714 2/20 0.61
▸ BLM P54132 2/20 0.61
▸ TDP1 Q9NUW8 2/20 0.61
▸ VDR P11473 2/20 0.61
▸ USP2 O75604 2/20 0.61
▸ CYP3A4 P08684 2/20 0.61
▸ LMNA P02545 2/20 0.61
▸ MDM4 O15151 1/20 0.61
▸ MAPT P10636 1/20 0.61

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
SCHEMBL3447573 0.93 CYP2D6 (0.65) CYP2C19CYP2D6OSBPOSBP2INPP5D
SCHEMBL28408 0.93 CYP2D6 (0.65) CYP2C19CYP2D6OSBPOSBP2INPP5D
SCHEMBL9224303 0.93 CYP2D6 (0.65) CYP2C19CYP2D6OSBPOSBP2INPP5D
SCHEMBL133952 0.93 CYP2D6 (0.65) CYP2C19CYP2D6OSBPOSBP2INPP5D
Water SCHEMBL4949873 0.92 CYP2D6 (0.64) CYP2C19CYP2D6OSBPOSBP2INPP5D
Methoxymethane SCHEMBL4786442 0.90 CYP2D6 (0.61) CYP2C19CYP2D6OSBPOSBP2INPP5D
Epicoprosterol SCHEMBL25267973 0.90 OSBP (0.78) CYP2C19CYP2D6OSBPOSBP2INPP5D
Epicoprosterol SCHEMBL11391325 0.90 OSBP (0.78) CYP2C19CYP2D6OSBPOSBP2INPP5D
Epicoprosterol SCHEMBL22018677 0.90 OSBP (0.78) CYP2C19CYP2D6OSBPOSBP2INPP5D
Epicoprosterol SCHEMBL21000320 0.90 OSBP (0.78) CYP2C19CYP2D6OSBPOSBP2INPP5D

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-20050032722-A1 SOLUBLE STEROIDAL PEPTIDES FOR NUCLEIC ACID DELIVERY UNIVERSITY OF UTAH RESEARCH FOUNDATION 2005-02-10 — — US disclosed