Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 4/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.46 |
| ▸ | GBA1 | P04062 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.44 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.43 |
| ▸ | CTSV | O60911 | 1/20 | 0.42 |
| ▸ | CTSL | P07711 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9337449 | 0.90 | CA1 (0.47) | CA1CA2CYP3A4LTA4HGBA1 | |
| SCHEMBL9335827 | 0.88 | CA1 (0.45) | CA1CA2CYP3A4LTA4HGBA1 | |
| SCHEMBL9865221 | 0.85 | FOLH1 (0.53) | NPC1RAB9AFOLH1CTSVCTSL | |
| SCHEMBL9865958 | 0.82 | CA1 (0.58) | CA1CA2CYP3A4GBA1HDAC8 | |
| SCHEMBL9864708 | 0.81 | HDAC8 (0.40) | CA1CA2LTA4HGBA1NPC1 | |
| SCHEMBL9866767 | 0.80 | CA1 (0.53) | CA1CA2CYP3A4GBA1HDAC8 | |
| SCHEMBL9866072 | 0.79 | LTA4H (0.47) | LTA4HNPC1RAB9AHDAC8HDAC3 | |
| SCHEMBL24413361 | 0.79 | CA1 (0.65) | CA1CA2CYP3A4GBA1HDAC8 | |
| SCHEMBL9866039 | 0.79 | LTA4H (0.46) | LTA4HNPC1RAB9AHDAC8FOLH1 | |
| SCHEMBL4837793 | 0.78 | CA1 (0.63) | CA1CA2CYP3A4LTA4HGBA1 |
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-5039805-A | Novel benzoic and phenylacetic acid derivatives | HOFFMANN-LA ROCHE INC. (US) | 1991-08-13 | — | — | US | disclosed |