Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 6/20 | 0.46 |
| ▸ | MAOB | P27338 | 3/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.44 |
| ▸ | SMYD3 | Q9H7B4 | 4/20 | 0.42 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL31718452 | 0.89 | MAOA (0.48) | MAOBCA1CA2HDAC3HDAC4 | |
| SCHEMBL27805290 | 0.82 | MAOB (0.49) | GAAMAOBCA2SMYD3AHR | |
| SCHEMBL11515388 | 0.80 | MAOB (0.50) | GAAMAOBSMYD3AHREIF2AK2 | |
| SCHEMBL6980695 | 0.79 | GAA (0.48) | GAAMAOBSMYD3AHREIF2AK2 | |
| SCHEMBL28346887 | 0.78 | GAA (0.52) | GAAMAOBAHREIF2AK2EPHX2 | |
| SCHEMBL10828352 | 0.77 | AHR (0.51) | GAAMAOBSMYD3AHREIF2AK2 | |
| SCHEMBL6981292 | 0.77 | AHR (0.51) | GAAMAOBSMYD3AHREIF2AK2 | |
| SCHEMBL27691373 | 0.76 | MAOB (0.50) | GAAMAOBSMYD3AHREIF2AK2 | |
| SCHEMBL10375833 | 0.74 | MAOB (0.65) | MAOBAHREIF2AK2KCNH2 | |
| SCHEMBL18885938 | 0.74 | AHR (0.49) | GAAMAOBSMYD3AHREPHX2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012025726-A1 | Novel Hybrid Compounds | UNIVERSITY OF GREENWICH (GB) | 2012-03-01 | — | — | WO | disclosed |
| WO-2012025726-A1 | Novel Hybrid Compounds | UNIVERSITY OF GREENWICH (GB) | 2012-03-01 | — | — | WO | disclosed |