Known targets — ChEMBL curated mechanism
ADRB1ADRB2ATP4AATP4BAXLCHRM2CHRM3DRD2FLT3HRH1HTR2AHTR2BHTR2CKCNH2KMT2AMAP2K1MAP2K2MEN1MLNRPLK4RENS1PR1SLC6A2SLC6A4atpAatpBatpCatpDatpEatpFatpFHatpGpol
The experimentally established mechanism targets of Nonane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 3/20 | 0.59 |
| ▸ | ATG4B | Q9Y4P1 | 11/20 | 0.49 |
| ▸ | PLA2G1B | P04054 | 9/20 | 0.49 |
| ▸ | THRA | P10827 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Nonane SCHEMBL8674797 | 1.00 | HCAR2 (0.59) | HCAR2ATG4BPLA2G1BTHRATHRB | |
| Octane SCHEMBL6872114 | 0.92 | HCAR2 (0.65) | HCAR2TDP1 | |
| Fumaric Acid SCHEMBL3414625 | 0.92 | HCAR2 (0.65) | HCAR2TDP1 | |
| Nonane SCHEMBL8691971 | 0.92 | HCAR2 (0.65) | HCAR2TDP1 | |
| Octane SCHEMBL2904002 | 0.92 | HCAR2 (0.65) | HCAR2TDP1 | |
| Fumaric Acid SCHEMBL3414623 | 0.92 | HCAR2 (0.65) | HCAR2TDP1 | |
| Nonane SCHEMBL8691965 | 0.92 | HCAR2 (0.65) | HCAR2TDP1 | |
| Octane SCHEMBL6872110 | 0.92 | HCAR2 (0.65) | HCAR2TDP1 | |
| Decane SCHEMBL9668679 | 0.92 | HCAR2 (0.65) | HCAR2TDP1 | |
| Octane SCHEMBL8193217 | 0.92 | HCAR2 (0.65) | HCAR2TDP1 |
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-5726323-A | COMPOUNDS USEFUL FOR ALLEVIATING MEMORY DYSFUNCTIONS | HOECHST MARION ROUSSEL, INC. | 1998-03-10 | — | — | US | disclosed |