Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.44 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | CA7 | P43166 | 3/20 | 0.44 |
| ▸ | CA9 | Q16790 | 3/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.44 |
| ▸ | PLK1 | P53350 | 1/20 | 0.43 |
| ▸ | PLK3 | Q9H4B4 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.38 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8655078 | 0.86 | PLK1 (0.51) | CA12CA1CA2CA7CA9 | |
| SCHEMBL8653008 | 0.83 | SMN1; SMN2 (0.56) | PLK1PLK3ALDH1A1NPC1RAB9A | |
| SCHEMBL8657531 | 0.82 | ALDH1A1 (0.56) | CA12CA1CA2CA7CA9 | |
| SCHEMBL8652836 | 0.82 | PLK1 (0.57) | PLK1PLK3ALDH1A1NPC1RAB9A | |
| SCHEMBL9145624 | 0.82 | NPC1 (0.59) | CA12CA1CA2CA7CA9 | |
| SCHEMBL9151043 | 0.82 | CA12 (0.41) | CA12CA1CA2CA7CA9 | |
| SCHEMBL8652584 | 0.82 | PLK1 (0.43) | CA12CA1CA2CA7CA9 | |
| SCHEMBL8655980 | 0.81 | PLK1 (0.59) | PLK1PLK3ALDH1A1NPC1RAB9A | |
| SCHEMBL8658169 | 0.81 | PLK1 (0.59) | PLK1PLK3ALDH1A1NPC1RAB9A | |
| SCHEMBL8655100 | 0.81 | PLK1 (0.59) | PLK1PLK3ALDH1A1NPC1RAB9A |
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-5476957-A | Dye for heat sensitive recording | MITSUI TOATSU CHEMICALS, INC. (JP) | 1995-12-19 | — | — | US | disclosed |