Ethane

Ethane

SCHEMBL5793409

CC.O=c1[nH]c2nc(Nc3ccccc3)ncc2cc1-c1c(Cl)cccc1Br

nearest known ligand 0.54

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Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ WEE1 P30291 9/20 0.54
▸ FGFR1 P11362 8/20 0.54
▸ SRC P12931 7/20 0.54
▸ EGFR P00533 6/20 0.54
▸ FGFR2 P21802 1/20 0.54
▸ FGFR4 P22455 1/20 0.54
▸ FGFR3 P22607 1/20 0.54
▸ ABL1 P00519 6/20 0.48
▸ PDGFRB P09619 5/20 0.48
▸ PDGFRA P16234 5/20 0.48
▸ MAPK14 Q16539 5/20 0.48
▸ KIT P10721 3/20 0.47
▸ PSEN1 P49768 1/20 0.46
▸ PSEN2 P49810 1/20 0.46
▸ APH1B Q8WW43 1/20 0.46
▸ NCSTN Q92542 1/20 0.46
▸ APH1A Q96BI3 1/20 0.46
▸ PSENEN Q9NZ42 1/20 0.46

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
Ethane SCHEMBL5761899 0.93 FGFR1 (0.62) WEE1FGFR1SRCEGFRFGFR2
SCHEMBL16986331 0.90 FGFR1 (0.61) WEE1FGFR1SRCEGFRFGFR2
SCHEMBL14161581 0.80 SRC (0.53) WEE1FGFR1SRCEGFRFGFR2
SCHEMBL12856330 0.78 ABL1 (0.69) WEE1FGFR1SRCEGFRFGFR2
SCHEMBL13038777 0.78 SYK (0.45) WEE1FGFR1SRCEGFRFGFR2
SCHEMBL5762216 0.77 FGFR1 (0.87) WEE1FGFR1SRCEGFRFGFR2
SCHEMBL14161490 0.77 SRC (0.53) WEE1FGFR1SRCEGFRFGFR2
SCHEMBL10276720 0.74 FGFR1 (0.65) WEE1FGFR1SRCEGFRFGFR2
SCHEMBL5619944 0.73 SRC (0.56) FGFR1SRCEGFRFGFR2FGFR4
SCHEMBL5764038 0.73 FGFR1 (0.68) WEE1FGFR1SRCEGFRFGFR2

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
EP-0823908-B1 PYRIDO[2,3-d]PYRIMIDINES FOR INHIBITING PROTEIN TYROSINE KINASE MEDIATED CELLULAR PROLIFERATION WARNER LAMBERT CO (US) 2006-11-02 — — EP claimed
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