Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | PPARD | Q03181 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | PLAU | P00749 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | MMP1 | P03956 | 1/20 | 0.30 |
| ▸ | MMP2 | P08253 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3091452 | 0.84 | TSHR (0.40) | TSHRPPARDCA12CA1CA2 | |
| SCHEMBL3102773 | 0.81 | TSHR (0.41) | TSHRPPARDCA12CA1CA2 | |
| SCHEMBL3109254 | 0.81 | TSHR (0.35) | TSHRPPARDCA12CA1CA2 | |
| SCHEMBL3103051 | 0.77 | CA12 (0.40) | TSHRPPARDCA12CA1CA2 | |
| SCHEMBL5273397 | 0.77 | TSHR (0.38) | TSHRPPARDCA12CA1CA2 | |
| SCHEMBL7938332 | 0.77 | PPARD (0.54) | TSHRPPARDCA12CA1CA2 | |
| SCHEMBL1980772 | 0.76 | TSHR (0.57) | TSHRPPARDCA12CA1CA2 | |
| SCHEMBL5839773 | 0.75 | PPARD (0.56) | TSHRPPARDCA12CA1CA2 | |
| SCHEMBL27807047 | 0.74 | PPARD (0.50) | TSHRPPARDCA12CA1CA2 | |
| SCHEMBL24475840 | 0.73 | PPARD (0.54) | TSHRPPARDCA12CA1CA2 |
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-20100247463-A1 | N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE | YU RUEY J | 2010-09-30 | — | — | US | claimed |