Tetrahydrofuran

Tetrahydrofuran

SCHEMBL29066948

C1CCOC1.[Br-].[Mg+]c1cccs1

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1

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 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.40
ALDH1A1 P00352 8/20 0.35
NPC1 O15118 4/20 0.33
RAB9A P51151 4/20 0.33
TP53 P04637 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 2/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
CYP2C19 P33261 1/20 0.31
KDM4E B2RXH2 2/20 0.30
LMNA P02545 1/20 0.30
ICMT O60725 1/20 0.30
ALOX15 P16050 1/20 0.30
HSD17B10 Q99714 1/20 0.30
GLA P06280 1/20 0.30
PRKDC P78527 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
Bromide SCHEMBL27529818 0.83
Tetrahydrofuran SCHEMBL27927339 0.78 HTT (0.40) HTTALDH1A1NPC1RAB9ATP53
Hydrochloric Acid SCHEMBL27546808 0.78
Iodide SCHEMBL27567051 0.78
Tetrahydrofuran SCHEMBL7246325 0.74 HTT (0.40) HTTALDH1A1NPC1RAB9ATP53
Tetrahydrofuran SCHEMBL27873625 0.74 HTT (0.40) HTTALDH1A1NPC1RAB9ATP53
Tetrahydrofuran SCHEMBL27873622 0.72 HTT (0.42) HTTALDH1A1MAPTHPGDKDM4E
Tetrahydrofuran SCHEMBL27479339 0.70 ALDH1A1 (0.40) HTTALDH1A1SMN1; SMN2MAPTKMT2A
Ether SCHEMBL27526903 0.68 DPP4 (0.41) ALDH1A1NPC1RAB9ASMN1; SMN2MAPT
Tetrahydrofuran SCHEMBL29120088 0.67 ALDH1A1 (0.33) ALDH1A1HSD17B10

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-116694161-A Acrylic polyurethane weather-resistant environment-friendly floor paint and preparation process thereof 宁波宣威彩色世界涂料有限公司 2023-09-05 CN claimed
CN-116694161-A Acrylic polyurethane weather-resistant environment-friendly floor paint and preparation process thereof 宁波宣威彩色世界涂料有限公司 2023-09-05 CN disclosed