Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA4 | P22748 | 2/20 | 0.39 |
| ▸ | CA6 | P23280 | 2/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.37 |
| ▸ | AKR1C4 | P17516 | 2/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.36 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.36 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | F11 | P03951 | 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 | |
|---|---|---|---|---|
| SCHEMBL2165311 | 0.75 | PTPN1 (0.48) | TTRPTPN1AKR1C4AKR1C3AKR1C2 | |
| SCHEMBL9117601 | 0.72 | F11 (0.46) | TTRCA1CA2CA4CA6 | |
| SCHEMBL6568533 | 0.71 | NPC1 (0.46) | TSHRALDH1A1 | |
| SCHEMBL6568622 | 0.70 | NPC1 (0.49) | TSHRALDH1A1 | |
| SCHEMBL9478488 | 0.69 | CYP1A2 (0.43) | TTRCA1CA2GPR35CYP1A2 | |
| SCHEMBL9476644 | 0.69 | TTR (0.38) | TTRCA1CA2CA4CA6 | |
| SCHEMBL22280548 | 0.68 | TDP1 (0.52) | TTRCA1CA2CA4CA6 | |
| SCHEMBL9116290 | 0.68 | F11 (0.44) | TTRCA1CA2CA4CA6 | |
| SCHEMBL69904 | 0.67 | CA1 (0.67) | TTRCA1CA2CA4CA6 | |
| SCHEMBL30009277 | 0.66 | TTR (0.52) | TTRCA1CA2CA4CA6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004012506-A2 | ANTIMICROBIAL COMPOUNDS | EXEGENICS, INC. (US) | 2004-02-12 | — | — | WO | disclosed |