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 | |
|---|---|---|---|---|
| ▸ | PABPC1 | P11940 | 1/20 | 0.63 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.63 |
| ▸ | EIF4H | Q15056 | 1/20 | 0.63 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.63 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.39 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.39 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | TTK | P33981 | 1/20 | 0.35 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.35 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.35 |
| ▸ | TERT | O14746 | 1/20 | 0.35 |
| ▸ | MELK | Q14680 | 1/20 | 0.34 |
| ▸ | GHSR | Q92847 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| Paraquat SCHEMBL3676472 | 0.89 | SLC6A4 (0.48) | PABPC1APOBEC3AEIF4HAPOBEC3GSLC6A4 | |
| SCHEMBL2819725 | 0.81 | PABPC1 (0.95) | PABPC1APOBEC3AEIF4HAPOBEC3GSLC6A4 | |
| Hydrochloric Acid SCHEMBL11471102 | 0.81 | PABPC1 (0.95) | PABPC1APOBEC3AEIF4HAPOBEC3GSLC6A4 | |
| Hydrochloric Acid SCHEMBL1405347 | 0.79 | PABPC1 (0.91) | PABPC1APOBEC3AEIF4HAPOBEC3GSLC6A4 | |
| Iodide SCHEMBL7138780 | 0.79 | PABPC1 (1.00) | PABPC1APOBEC3AEIF4HAPOBEC3GSLC6A4 | |
| Hydrochloric Acid SCHEMBL28126821 | 0.79 | PABPC1 (0.91) | PABPC1APOBEC3AEIF4HAPOBEC3GSLC6A4 | |
| SCHEMBL10844389 | 0.79 | PABPC1 (0.58) | PABPC1APOBEC3AEIF4HAPOBEC3GSLC6A4 | |
| Iodide SCHEMBL2817451 | 0.77 | PABPC1 (0.95) | PABPC1APOBEC3AEIF4HAPOBEC3GSLC6A4 | |
| Hydrochloric Acid SCHEMBL27906760 | 0.77 | PABPC1 (0.86) | PABPC1APOBEC3AEIF4HAPOBEC3GSLC6A4 | |
| Paraquat SCHEMBL11565178 | 0.77 | SLC6A4 (0.56) | PABPC1APOBEC3AEIF4HAPOBEC3GSLC6A4 |
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-4223150-A | QUATERNIZING 4,4'-BIPYRIDYL USING AN A-HALO-ORGANIC ACID | CHENG HONG CHEMICAL CO., LTD. (TW) | 1980-09-16 | — | — | US | disclosed |