Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.36 |
| ▸ | GRM3 | Q14832 | 2/20 | 0.36 |
| ▸ | GRM4 | Q14833 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | GRM8 | O00222 | 1/20 | 0.36 |
| ▸ | GRM6 | O15303 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.36 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.36 |
| ▸ | PLCB1 | Q9NQ66 | 1/20 | 0.36 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12482450 | 0.81 | TSHR (0.45) | TSHRGRM2GRM3GRM4CYP2C19 | |
| SCHEMBL19304 | 0.80 | TSHR (0.38) | TSHRGRM2GRM3GRM4CYP2C19 | |
| SCHEMBL30243980 | 0.77 | KDM4E (0.33) | HSD11B1 | |
| SCHEMBL26913607 | 0.76 | CYP2C19 (0.39) | TSHRGRM2GRM3GRM4CYP2C19 | |
| SCHEMBL26913605 | 0.76 | CYP2C19 (0.39) | TSHRGRM2GRM3GRM4CYP2C19 | |
| SCHEMBL30770084 | 0.74 | APLNR (0.43) | TSHRGRM2GRM3GRM4CYP2C19 | |
| SCHEMBL17540965 | 0.74 | APLNR (0.43) | TSHRGRM2GRM3GRM4CYP2C19 | |
| SCHEMBL583655 | 0.73 | ALOX15 (0.44) | TSHRGRM2GRM3GRM4CYP2C19 | |
| SCHEMBL4019338 | 0.73 | TSHR (0.42) | TSHRGRM2GRM3GRM4CYP2C19 | |
| SCHEMBL18204574 | 0.73 | TSHR (0.42) | TSHRGRM2GRM3GRM4CYP2C19 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2480557-A2 | PROCESS FOR THE PREPARATION OF RAPAMYCIN DERIVATIVES | Cadila Healthcare Limited (IN) | 2012-08-01 | — | — | EP | disclosed |
| WO-2011051960-A2 | PROCESS FOR THE PREPARATION OF RAPAMYCIN DERIVATIVES | CADILA HEALTHCARE LIMITED (IN) | 2011-05-05 | — | — | WO | disclosed |