Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.96 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.96 |
| ▸ | AKR1C1 | Q04828 | 3/20 | 0.96 |
| ▸ | AKR1C4 | P17516 | 2/20 | 0.96 |
| ▸ | PTPN1 | P18031 | 4/20 | 0.60 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.55 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.55 |
| ▸ | HSPD1 | P10809 | 2/20 | 0.54 |
| ▸ | HSPE1 | P61604 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | EGFR | P00533 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL330545 | 0.98 | AKR1C3 (1.00) | AKR1C3AKR1C2AKR1C1AKR1C4PTPN1 | |
| SCHEMBL29387062 | 0.98 | AKR1C3 (1.00) | AKR1C3AKR1C2AKR1C1AKR1C4PTPN1 | |
| SCHEMBL9398447 | 0.96 | AKR1C3 (0.96) | AKR1C3AKR1C2AKR1C1AKR1C4PTPN1 | |
| SCHEMBL9398455 | 0.96 | AKR1C3 (0.96) | AKR1C3AKR1C2AKR1C1AKR1C4PTPN1 | |
| SCHEMBL9019697 | 0.96 | AKR1C3 (0.96) | AKR1C3AKR1C2AKR1C1AKR1C4PTPN1 | |
| Hydrochloric Acid SCHEMBL11781789 | 0.96 | AKR1C3 (0.96) | AKR1C3AKR1C2AKR1C1AKR1C4PTPN1 | |
| Water SCHEMBL9399153 | 0.94 | AKR1C3 (0.92) | AKR1C3AKR1C2AKR1C1AKR1C4PTPN1 | |
| Water SCHEMBL9399165 | 0.94 | AKR1C3 (0.92) | AKR1C3AKR1C2AKR1C1AKR1C4PTPN1 | |
| Fumaric Acid SCHEMBL28077711 | 0.88 | AKR1C3 (0.81) | AKR1C3AKR1C2AKR1C1AKR1C4PTPN1 | |
| Fumaric Acid SCHEMBL27584103 | 0.88 | AKR1C3 (0.81) | AKR1C3AKR1C2AKR1C1AKR1C4PTPN1 |
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-5300389-A | Toner compositions with halogenated aluminum salicylic acid complex charge enhancing additives | XEROX CORPORATION (US) | 1994-04-05 | — | — | US | disclosed |