Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.39 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.36 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.36 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.36 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7705155 | 0.80 | CA2 (0.48) | CA2HDAC3HDAC1HDAC2HDAC11 | |
| SCHEMBL6908926 | 0.73 | PTPN1 (0.39) | CA2PTPN1CNR2MEN1KMT2A | |
| SCHEMBL14093700 | 0.68 | SQLE (0.43) | CA2CNR2HDAC3HDAC1HDAC2 | |
| SCHEMBL3886237 | 0.68 | TRPM8 (0.49) | CA2TAS2R14ALDH1A1HDAC6 | |
| SCHEMBL5596821 | 0.68 | CA2 (0.46) | CA2NR3C1AKR1B1 | |
| SCHEMBL4790573 | 0.66 | CA2 (0.54) | CA2KMT2ABCL2L1L3MBTL1HTT | |
| Naphthalene SCHEMBL11617631 | 0.66 | CA2 (0.62) | CA2HDAC3HDAC1HDAC2HDAC11 | |
| SCHEMBL329450 | 0.66 | CA2 (0.67) | CA2HDAC3HDAC1HDAC2HDAC11 | |
| SCHEMBL3872157 | 0.65 | PPARG (0.45) | CA2MEN1KMT2AALDH1A1HDAC3 | |
| SCHEMBL329294 | 0.65 | CA2 (0.71) | CA2HDAC3HDAC1HDAC2HDAC11 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004048393-A2 | NOVEL INHIBITORS OF β-LACTAMASE | METHYLGENE, INC. (CA) | 2004-06-10 | — | — | WO | disclosed |