Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.45 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.45 |
| ▸ | TUBB | P07437 | 2/20 | 0.45 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.45 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.45 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.45 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.45 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.45 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.45 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.45 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4513429 | 0.85 | TUBB4A (0.53) | ALDH1A1GAATUBB4ATUBBTUBA3C | |
| SCHEMBL7687597 | 0.85 | ALDH1A1 (0.47) | ALDH1A1GAANPC1RAB9ACA12 | |
| SCHEMBL31193435 | 0.81 | CA12 (0.65) | ALDH1A1CA12CA1CA2CA7 | |
| SCHEMBL23484366 | 0.80 | EPHX2 (0.40) | ALDH1A1GAACA12CA1CA2 | |
| SCHEMBL581508 | 0.80 | TUBB4A (0.63) | ALDH1A1GAANPC1RAB9ACA12 | |
| SCHEMBL24436862 | 0.80 | CYP3A4 (0.49) | GAANPC1RAB9ACA12CA9 | |
| SCHEMBL16952355 | 0.79 | CA12 (0.47) | ALDH1A1GAANPC1RAB9ACA12 | |
| SCHEMBL30289783 | 0.79 | CA12 (0.47) | ALDH1A1NPC1RAB9ACA12CA1 | |
| SCHEMBL13785412 | 0.79 | PDE2A (0.47) | ALDH1A1GAANPC1RAB9ACA12 | |
| SCHEMBL263498 | 0.79 | CA12 (0.47) | ALDH1A1NPC1RAB9ACA12CA1 |
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-20220157484-A1 | POLYURETHANE, POLYURETHANE PRODUCTION METHOD, CONDUCTIVE PASTE COMPOSITION, CONDUCTIVE WIRE, AND METHOD FOR PRODUCING CONDUCTIVE WIRE | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2022-05-19 | — | — | US | disclosed |