Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA7 | P43166 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 2/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7989942 | 1.00 | CA1 (0.47) | CA1CA2CA7CA9HSP90AA1 | |
| SCHEMBL7509273 | 1.00 | CA1 (0.47) | CA1CA2CA7CA9HSP90AA1 | |
| SCHEMBL7992780 | 0.94 | IDO1 (0.41) | CA1CA2CA7CA9HSP90AA1 | |
| SCHEMBL7976176 | 0.92 | MEN1 (0.49) | KMT2AMEN1 | |
| SCHEMBL7447822 | 0.91 | HSP90AA1 (0.44) | CA1CA2CA7CA9HSP90AA1 | |
| SCHEMBL5742123 | 0.91 | CA1 (0.56) | CA1CA2CA7CA9TSHR | |
| SCHEMBL7990123 | 0.89 | ESR1 (0.39) | CA1CA2CA7CA9HSP90AA1 | |
| SCHEMBL7987303 | 0.89 | HSP90AA1 (0.43) | CA1CA2CA7CA9HSP90AA1 | |
| SCHEMBL7511171 | 0.89 | KMT2A (0.43) | CA1CA2CA7CA9HSP90AA1 | |
| SCHEMBL7456130 | 0.89 | KMT2A (0.43) | CA1CA2CA7CA9HSP90AA1 |
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-6313177-B1 | AS ANTIVIRAL AGENTS | PHARMACOR INC. (CA) | 2001-11-06 | — | — | US | disclosed |