Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 5/20 | 0.55 |
| ▸ | CA1 | P00915 | 4/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.46 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL8338918 | 0.89 | CA2 (0.61) | CA2CA1HTTKDM4CKDM4E | |
| SCHEMBL2172294 | 0.89 | CA2 (0.61) | CA2CA1HTTKDM4CKDM4E | |
| Valine SCHEMBL17036707 | 0.86 | SLC1A2 (0.61) | CA2CA1SLC1A2ALDH1A1KMT2A | |
| Valine SCHEMBL17036694 | 0.86 | SLC1A2 (0.61) | CA2CA1SLC1A2ALDH1A1KMT2A | |
| Valine SCHEMBL17036690 | 0.86 | SLC1A2 (0.61) | CA2CA1SLC1A2ALDH1A1KMT2A | |
| Valine SCHEMBL17036704 | 0.85 | CA2 (0.55) | CA2CA1SLC1A2ALDH1A1LMNA | |
| SCHEMBL11103451 | 0.80 | CA2 (0.71) | CA2CA1HTTKDM4CALDH1A1 | |
| SCHEMBL11103438 | 0.80 | CA2 (0.71) | CA2CA1HTTKDM4CALDH1A1 | |
| SCHEMBL17036699 | 0.80 | HTT (0.47) | CA2CA1HTTKDM4EALDH1A1 | |
| SCHEMBL8805714 | 0.78 | HTT (0.57) | CA2CA1HTTKDM4EALDH1A1 |
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-9120722-B1 | Optically active valine complex and a method for producing the same | Wellman Biosciences Co. Ltd. (CN) | 2015-09-01 | — | — | US | disclosed |