Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL395477 | 0.87 | — | — | |
| SCHEMBL4577668 | 0.84 | — | — | |
| Fluoride Ion SCHEMBL1130889 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL5992971 | 0.82 | TDP1 (0.30) | — | |
| Tetrahydrofuran SCHEMBL27364464 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL1116203 | 0.81 | ACHE (0.33) | — | |
| Hydrochloric Acid SCHEMBL1116120 | 0.81 | ACHE (0.33) | — | |
| Hydrochloric Acid SCHEMBL1070986 | 0.80 | — | — | |
| Tetrahydrofuran SCHEMBL6214484 | 0.79 | LMNA (0.30) | — | |
| Tetrahydrofuran SCHEMBL27343329 | 0.79 | — | — |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6057467-A | CYCLOPENTADIENE LIGANDS WITH GROUP IVB METALS | RESEARCH INSTITUTE OF PETROLEUM PROCESSING, SINOPEC (CN) | 2000-05-02 | — | — | US | disclosed |