Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 known ✓ | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 7/20 | 0.68 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | RAD52 | P43351 | 2/20 | 0.36 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL862249 | 0.82 | — | — | |
| SCHEMBL8988114 | 0.82 | HDAC8 (1.00) | HDAC8KDM4ESMN1; SMN2ALDH1A1KCNH2 | |
| Hydrochloric Acid SCHEMBL5833068 | 0.80 | HDAC8 (0.95) | HDAC8KDM4ESMN1; SMN2KCNH2 | |
| Iodide SCHEMBL30133746 | 0.80 | HDAC8 (0.95) | HDAC8KDM4ESMN1; SMN2ALDH1A1RAB9A | |
| SCHEMBL8002510 | 0.76 | NPSR1 (0.43) | HDAC8NPSR1RAD52PSMD14LMNA | |
| Hydrochloric Acid SCHEMBL10612624 | 0.75 | HDAC8 (0.64) | HDAC8 | |
| SCHEMBL577775 | 0.75 | HDAC8 (0.75) | HDAC8NPSR1LMNAALDH1A1KCNH2 | |
| SCHEMBL11483152 | 0.75 | HDAC8 (0.64) | HDAC8NPSR1RAD52PSMD14LMNA | |
| SCHEMBL11256315 | 0.75 | NPSR1 (0.39) | HDAC8NPSR1RAD52PSMD14LMNA | |
| SCHEMBL11421745 | 0.75 | HTR1A (0.43) | HDAC8NPSR1RAD52PSMD14LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1854786-A1 | Ionic liquids and their use in extraction processes | BP p.l.c. (GB) | 2007-11-14 | — | — | EP | disclosed |