Tetrahydrofuran

Tetrahydrofuran

SCHEMBL28044988

C1CCOC1.CC#N.CC(=O)O.ClCCl.O

nearest known ligand 0.33

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Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Tetrahydrofuran. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
GLA P06280 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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
Tetrahydrofuran SCHEMBL3367682 0.91 ALDH1A1 (0.40) ALDH1A1GLASMN1; SMN2
Tetrahydrofuran SCHEMBL28342643 0.89 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2
Tetrahydrofuran SCHEMBL7279007 0.89 ALDH1A1 (0.42) ALDH1A1GLASMN1; SMN2
Tetrahydrofuran SCHEMBL28993307 0.87 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2
Tetrahydrofuran SCHEMBL4406239 0.87 ALDH1A1 (0.44) ALDH1A1
Tetrahydrofuran SCHEMBL7645655 0.82 ALDH1A1 (0.50) ALDH1A1GLASMN1; SMN2
Tetrahydrofuran SCHEMBL1056026 0.82 ALDH1A1 (0.50) ALDH1A1GLASMN1; SMN2
Tetrahydrofuran SCHEMBL11401799 0.82 ALDH1A1 (0.50) ALDH1A1GLASMN1; SMN2
Acetic Acid SCHEMBL6619942 0.82 FFAR3 (0.44) ALDH1A1
Tetrahydrofuran SCHEMBL28312571 0.81 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105193826-B The preparation method of vitamine D3 premix and its vitamine D3 premix obtained 黄玉萍 2019-01-08 CN disclosed
CN-105193826-A Preparation method of vitamin D3 premix and vitamin D3 premix prepared through preparation method HUANG YUPING 2015-12-30 CN disclosed