Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA4 | P22748 | 1/20 | 0.50 |
| ▸ | CA6 | P23280 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | TPMT | P51580 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7635516 | 1.00 | HDAC6 (0.50) | HDAC6CA12CA1CA2CA4 | |
| SCHEMBL7634858 | 0.99 | CA12 (0.51) | HDAC6CA12CA1CA2CA4 | |
| SCHEMBL7632102 | 0.89 | TSHR (0.54) | HDAC6CA12CA1CA2CA4 | |
| SCHEMBL7959660 | 0.86 | HDAC6 (0.68) | HDAC6CA12CA1CA2CA4 | |
| SCHEMBL7630377 | 0.85 | CYP3A4 (0.51) | HDAC6TSHRCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7635826 | 0.85 | CYP3A4 (0.51) | HDAC6TSHRCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7627945 | 0.85 | CYP3A4 (0.51) | HDAC6TSHRCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7956506 | 0.85 | HDAC6 (0.65) | HDAC6CA12CA1CA2CA4 | |
| SCHEMBL7634348 | 0.83 | SLC29A1 (0.50) | HDAC6TSHRCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7634506 | 0.83 | MAPT (0.56) | CA12CA1CA2CA4CA6 |
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-1233014-A1 | ASYMMETRIC ORGANIC PEROXIDE, CROSSLINKING AGENT COMPRISING THE SAME, AND METHOD OF CROSSLINKING WITH THE SAME | NOF CORPORATION (JP) | 2002-08-21 | — | — | EP | disclosed |