Hydrogen Sulfide

Hydrogen Sulfide

SCHEMBL8052104

CC(C(=O)O)c1ccccn1.S.S

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.60
CYP1A2 P05177 2/20 0.60
ALDH1A1 P00352 3/20 0.54
SLC6A3 Q01959 2/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A4 P31645 1/20 0.47
POLB P06746 1/20 0.46
KDM4E B2RXH2 3/20 0.46
NPSR1 Q6W5P4 1/20 0.44
PTGS2 P35354 1/20 0.44
LMNA P02545 3/20 0.44
TSHR P16473 3/20 0.44
ABCB11 O95342 1/20 0.44
ESR1 P03372 1/20 0.44
ADRA2A P08913 1/20 0.44
CYP2C9 P11712 1/20 0.44
PDE4A P27815 1/20 0.44
ADRA1A P35348 1/20 0.44
OPRK1 P41145 1/20 0.44
STAT6 P42226 1/20 0.44

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
SCHEMBL933349 0.98 CYP3A4 (0.62) CYP3A4CYP1A2ALDH1A1SLC6A3SLC6A2
SCHEMBL6264784 0.98 CYP3A4 (0.62) CYP3A4CYP1A2ALDH1A1SLC6A3SLC6A2
Hydrochloric Acid SCHEMBL28672927 0.96 CYP3A4 (0.60) CYP3A4CYP1A2ALDH1A1SLC6A3SLC6A2
SCHEMBL3289319 0.86 CYP3A4 (0.62) CYP3A4CYP1A2ALDH1A1SLC6A3SLC6A2
SCHEMBL9484896 0.84 CYP1A2 (0.49) CYP3A4CYP1A2ALDH1A1SLC6A2POLB
SCHEMBL27536605 0.84 CYP1A2 (0.64) CYP3A4CYP1A2ALDH1A1SLC6A3SLC6A2
SCHEMBL2398644 0.81 CYP1A2 (0.81) CYP3A4CYP1A2ALDH1A1SLC6A3SLC6A2
SCHEMBL4389584 0.81 CYP3A4 (0.60) CYP3A4CYP1A2ALDH1A1SLC6A3SLC6A2
SCHEMBL29627913 0.81 CYP1A2 (0.60) CYP3A4CYP1A2ALDH1A1SLC6A3SLC6A2
SCHEMBL626825 0.81 CYP1A2 (0.60) CYP3A4CYP1A2ALDH1A1SLC6A3SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6096315-A IMMUNOMODULATORS FOR DISEASE PREVENTION CEL SCI CORPORATION (US) 2000-08-01 US disclosed
US-5652342-A Heterofunctional cellular immunological reagents, vaccines containing same and methods for the use of same CEL-SCI CORPORATION (US) 1997-07-29 US disclosed
EP-0420913-B1 HETEROFUNCTIONAL CELLULAR IMMUNOLOGICAL REAGENTS, VACCINES CONTAINING SAME AND METHODS FOR THE USE OF SAME CELL MED INC (US) 1995-11-15 EP disclosed
EP-0420913-A4 HETEROFUNCTIONAL CELLULAR IMMUNOLOGICAL REAGENTS, VACCINES CONTAINING SAME AND METHODS FOR THE USE OF SAME 1991-09-11 EP disclosed
EP-0420913-A1 HETEROFUNCTIONAL CELLULAR IMMUNOLOGICAL REAGENTS, VACCINES CONTAINING SAME AND METHODS FOR THE USE OF SAME. CELL MED INC (US) 1991-04-10 EP disclosed
WO-1989012458-A1 HETEROFUNCTIONAL CELLULAR IMMUNOLOGICAL REAGENTS, VACCINES CONTAINING SAME AND METHODS FOR THE USE OF SAME CELL MED, INC. (US) 1989-12-28 WO disclosed