Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.36 |
| ▸ | SGPL1 | O95470 | 1/20 | 0.36 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL12827070 | 0.83 | TSHR (0.41) | SMN1; SMN2ALDH1A1TDP1TSHR | |
| SCHEMBL14732471 | 0.82 | SMN1; SMN2 (0.33) | SMN1; SMN2ALDH1A1TDP1TSHRPDK1 | |
| SCHEMBL8928155 | 0.80 | SMN1; SMN2 (0.58) | SMN1; SMN2ALDH1A1TDP1TSHRS1PR1 | |
| SCHEMBL18357299 | 0.80 | TSHR (0.42) | SMN1; SMN2ALDH1A1TDP1TSHR | |
| SCHEMBL10034830 | 0.79 | TSHR (0.35) | SMN1; SMN2ALDH1A1TDP1TSHR | |
| SCHEMBL25906792 | 0.79 | TSHR (0.33) | SMN1; SMN2ALDH1A1TDP1TSHR | |
| SCHEMBL13449250 | 0.77 | SMN1; SMN2 (0.58) | SMN1; SMN2ALDH1A1TDP1TSHRPDK1 | |
| SCHEMBL11073050 | 0.77 | ALDH1A1 (0.42) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL9880246 | 0.76 | TSHR (0.36) | SMN1; SMN2ALDH1A1TDP1TSHR | |
| SCHEMBL24520577 | 0.75 | ALDH1A1 (0.57) | SMN1; SMN2ALDH1A1TDP1TSHRS1PR1 |
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-2016046178-A1 | SILICONE COMPOUNDS AND COMPOSITIONS THEREOF FOR THE TREATMENT OF AMINO ACID BASED SUBSTRATES | MOMENTIVE PERFORMANCE MATERIALS GMBH (DE) | 2016-03-31 | — | — | WO | disclosed |