Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.37 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.37 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | AAK1 | Q2M2I8 | 3/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | PDE2A | O00408 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14889555 | 0.82 | CYP3A4 (0.38) | HDAC3CYP2C9HDAC4HDAC1HDAC7 | |
| SCHEMBL17703537 | 0.77 | CYP3A4 (0.40) | CYP3A4SLC6A2SLC6A4SLC6A3CYP2C19 | |
| SCHEMBL16296471 | 0.77 | HDAC3 (0.41) | HDAC3CYP2C9HDAC4HDAC1HDAC7 | |
| SCHEMBL6265732 | 0.69 | SLC6A2 (0.42) | SLC6A2SLC6A4SLC6A3GAAALDH1A1 | |
| SCHEMBL11728032 | 0.69 | TAAR1 (0.60) | CYP3A4SLC6A2SLC6A4SLC6A3CYP2C19 | |
| SCHEMBL9586848 | 0.68 | SLC6A2 (0.41) | SLC6A2SLC6A4SLC6A3CYP2C19GAA | |
| SCHEMBL23956932 | 0.66 | TAAR1 (0.39) | CYP2C9CYP3A4SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL17469429 | 0.66 | CYP3A4 (0.44) | CYP2C9CYP3A4SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL10031596 | 0.66 | CYP3A4 (0.44) | CYP2C9CYP3A4SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL117057 | 0.66 | CYP3A4 (0.44) | CYP2C9CYP3A4SLC6A2SLC6A4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2203160-A1 | PHARMACOLOGICAL ADJUNCTIVE TREATMENT ASSOCIATED WITH GLAUCOMA FILTRATION SURGERY | Bausch & Lomb Incorporated (US) | 2010-07-07 | — | — | EP | disclosed |
| WO-2009042377-A1 | PHARMACOLOGICAL ADJUNCTIVE TREATMENT ASSOCIATED WITH GLAUCOMA FILTRATION SURGERY | BAUSCH & LOMB INCORPORATED (US) | 2009-04-02 | — | — | WO | disclosed |