Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.43 |
| ▸ | F12 | P00748 | 3/20 | 0.42 |
| ▸ | MGAM | O43451 | 1/20 | 0.42 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MIF | P14174 | 1/20 | 0.42 |
| ▸ | SI | P14410 | 1/20 | 0.42 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL24988440 | 0.81 | KCNMA1 (0.45) | SMN1; SMN2KDM4ELMNANPSR1TSHR | |
| SCHEMBL21183124 | 0.76 | KCNMA1 (0.59) | SMN1; SMN2KDM4ELMNANPSR1TSHR | |
| SCHEMBL2095767 | 0.72 | KDM4E (0.59) | SMN1; SMN2KDM4ELMNANPSR1TSHR | |
| SCHEMBL13620481 | 0.72 | SMN1; SMN2 (0.53) | SMN1; SMN2KDM4ELMNANPSR1TSHR | |
| SCHEMBL2092784 | 0.72 | SMN1; SMN2 (0.59) | SMN1; SMN2KDM4ELMNANPSR1TSHR | |
| SCHEMBL25922416 | 0.70 | KCNMA1 (0.46) | SMN1; SMN2KDM4ELMNANPSR1TSHR | |
| SCHEMBL12202056 | 0.70 | GAA (0.47) | SMN1; SMN2KDM4ELMNANPSR1TSHR | |
| SCHEMBL24633510 | 0.68 | KCNMA1 (0.47) | SMN1; SMN2KDM4ELMNANPSR1TSHR | |
| SCHEMBL31062981 | 0.67 | HTT (0.38) | LMNARAB9A | |
| SCHEMBL29193567 | 0.67 | SMN1; SMN2 (0.47) | SMN1; SMN2KDM4ELMNANPSR1TSHR |
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-2468735-A1 | Synthesis of intermediates for preparing anacetrapib and derivates thereof | LEK Pharmaceuticals d.d. (SI) | 2012-06-27 | — | — | EP | disclosed |