Epoprostenol

Epoprostenol

SCHEMBL5452422

CCCCC[C@H](O)/C=C/[C@@H]1[C@H]2C/C(=C/CCCC(=O)O)O[C@H]2C[C@H]1O.CCCCC[C@H](O)/C=C/[C@@H]1[C@H]2C/C(=C/CCCC(=O)[O-])O[C@H]2C[C@H]1O.[Na+]

nearest known ligand 0.90

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PTGIR

The experimentally established mechanism targets of Epoprostenol. 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
PTGIR known ✓ P43119 6/20 0.51
ALDH1A1 P00352 5/20 0.90
MEN1 O00255 2/20 0.65
KMT2A Q03164 2/20 0.65
PPARG P37231 1/20 0.65
PPARD Q03181 1/20 0.65
PPARA Q07869 1/20 0.65
PTGER4 P35408 5/20 0.52
TBXA2R P21731 3/20 0.52
PTGER1 P34995 3/20 0.52
PTGER3 P43115 3/20 0.52
PTGFR P43088 2/20 0.52
LMNA P02545 2/20 0.52
PTGDR Q13258 1/20 0.52
SLCO2A1 Q92959 1/20 0.52
PTGER2 P43116 4/20 0.51
TSHR P16473 3/20 0.51
HPGD P15428 2/20 0.51
MAPK1 P28482 2/20 0.51
NR1I2 O75469 1/20 0.51

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
Epoprostenol SCHEMBL29121502 0.96 ALDH1A1 (0.82) ALDH1A1MEN1KMT2APPARGPPARD
Epoprostenol SCHEMBL128619 0.96 ALDH1A1 (0.82) ALDH1A1MEN1KMT2APPARGPPARD
Epoprostenol SCHEMBL41344 0.96 ALDH1A1 (0.82) ALDH1A1MEN1KMT2APPARGPPARD
Epoprostenol SCHEMBL4299219 0.96 ALDH1A1 (0.82) ALDH1A1MEN1KMT2APPARGPPARD
Epoprostenol SCHEMBL24033081 0.95 ALDH1A1 (1.00) ALDH1A1MEN1KMT2APPARGPPARD
Epoprostenol SCHEMBL705594 0.95 ALDH1A1 (1.00) ALDH1A1MEN1KMT2APPARGPPARD
Epoprostenol SCHEMBL16783374 0.95 ALDH1A1 (1.00) ALDH1A1MEN1KMT2APPARGPPARD
Epoprostenol SCHEMBL24612535 0.95 ALDH1A1 (1.00) ALDH1A1MEN1KMT2APPARGPPARD
Epoprostenol SCHEMBL22607961 0.95 ALDH1A1 (1.00) ALDH1A1MEN1KMT2APPARGPPARD
Epoprostenol SCHEMBL21283002 0.95 ALDH1A1 (1.00) ALDH1A1MEN1KMT2APPARGPPARD

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180021347-A1 COMPOSITION FOR THE TREATMENT OF HEPATIC VENO-OCCLUSIVE DISEASE SCIPHARM SÀRL (LU) 2018-01-25 US disclosed
EP-3250289-A1 COMPOSITION FOR THE TREATMENT OF HEPATIC VENO-OCCLUSIVE DISEASE SciPharm SàRL (LU) 2017-12-06 EP disclosed
WO-2016120311-A1 COMPOSITION FOR THE TREATMENT OF HEPATIC VENO-OCCLUSIVE DISEASE SCIPHARM SÀRL (LU) 2016-08-04 WO disclosed
US-8585753-B2 Fibrillated biodegradable prosthesis SCANLON JOHN JAMES (US) 2013-11-19 US disclosed
US-20070207186-A1 Tear and abrasion resistant expanded material and reinforcement SCANLON JOHN J 2007-09-06 US disclosed