Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MIF | P14174 | 1/20 | 0.47 |
| ▸ | HCAR2 | Q8TDS4 | 5/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.41 |
| ▸ | TNKS | O95271 | 1/20 | 0.41 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA4 | P22748 | 3/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12078966 | 0.78 | CA1 (0.50) | MIFHCAR2HDAC3HDAC4HDAC1 | |
| SCHEMBL5283646 | 0.77 | HCAR2 (0.47) | HCAR2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL9756815 | 0.77 | HCAR2 (0.47) | MIFHCAR2HDAC3HDAC4HDAC1 | |
| SCHEMBL9756842 | 0.77 | AKR1C3 (0.47) | MIFHCAR2HDAC3HDAC4HDAC1 | |
| SCHEMBL5283644 | 0.77 | HCAR2 (0.47) | HCAR2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL9756843 | 0.77 | AKR1C3 (0.47) | MIFHCAR2HDAC3HDAC4HDAC1 | |
| SCHEMBL9756814 | 0.77 | HCAR2 (0.47) | MIFHCAR2HDAC3HDAC4HDAC1 | |
| SCHEMBL15609752 | 0.76 | HCAR2 (0.46) | MIFHCAR2HDAC3HDAC4HDAC1 | |
| SCHEMBL15609751 | 0.76 | HCAR2 (0.46) | MIFHCAR2HDAC3HDAC4HDAC1 | |
| SCHEMBL28744844 | 0.73 | HCAR2 (0.43) | HCAR2HDAC3HDAC4HDAC1HDAC7 |
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-2019038362-A1 | ANTIBACTERIAL PYRROLOIMIDAZOLONES | IDORSIA PHARMACEUTICALS LTD (CH) | 2019-02-28 | — | — | WO | disclosed |