Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 4/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MLYCD | O95822 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | CTSL | P07711 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL17036699 | 0.86 | HTT (0.47) | ALDH1A1KMT2ALMNACA2CA1 | |
| SCHEMBL17036691 | 0.86 | SLC1A2 (0.49) | ALDH1A1HPGDKMT2ALMNACA2 | |
| SCHEMBL17036696 | 0.86 | SLC1A2 (0.49) | ALDH1A1HPGDKMT2ALMNACA2 | |
| SCHEMBL31596283 | 0.81 | TSHR (0.57) | ALDH1A1NPC1HPGDKMT2ALMNA | |
| Valine SCHEMBL17036704 | 0.80 | CA2 (0.55) | ALDH1A1NPC1HPGDKMT2ALMNA | |
| SCHEMBL2185023 | 0.75 | MLYCD (0.65) | ALDH1A1NPC1HPGDKMT2ALMNA | |
| SCHEMBL26763424 | 0.75 | MLYCD (0.65) | ALDH1A1NPC1HPGDKMT2ALMNA | |
| SCHEMBL3995344 | 0.74 | NPC1 (0.63) | ALDH1A1NPC1HPGDKMT2ALMNA | |
| SCHEMBL3995339 | 0.74 | NPC1 (0.63) | ALDH1A1NPC1HPGDKMT2ALMNA | |
| Hydrochloric Acid SCHEMBL9638714 | 0.73 | MLYCD (0.62) | ALDH1A1NPC1HPGDKMT2ALMNA |
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 |