Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTB4R | Q15722 | 1/20 | 0.51 |
| ▸ | CYSLTR2 | Q9NS75 | 4/20 | 0.50 |
| ▸ | CYSLTR1 | Q9Y271 | 4/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.47 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7829813 | 0.86 | HDAC1 (0.56) | HDAC1HDAC2HDAC3HDAC4HDAC7 | |
| Iodide SCHEMBL28230532 | 0.81 | PDE10A (0.49) | LTB4RCYSLTR2CYSLTR1CYP1A2CYP2C19 | |
| SCHEMBL5928217 | 0.80 | NCF1 (0.54) | CYP1A2CYP2C19ALDH1A1CYP2E1CYP2C8 | |
| SCHEMBL7831703 | 0.76 | CYSLTR1 (0.64) | LTB4RCYSLTR2CYSLTR1CYP1A2MAPT | |
| SCHEMBL8649122 | 0.76 | CYSLTR1 (0.64) | LTB4RCYSLTR2CYSLTR1CYP1A2MAPT | |
| SCHEMBL14127808 | 0.76 | NCF1 (0.56) | CYP1A2CYP2C19ALDH1A1HPGDCYP2E1 | |
| SCHEMBL9119048 | 0.76 | KDM4E (0.48) | CYP1A2ALDH1A1HPGDHSD17B10KDM4E | |
| SCHEMBL14352239 | 0.75 | NCF1 (0.58) | CYP1A2CYP2C19ALDH1A1CYP2E1CYP2C8 | |
| SCHEMBL9952773 | 0.75 | CYSLTR1 (0.66) | LTB4RCYSLTR2CYSLTR1CYP1A2MAPT | |
| SCHEMBL27596905 | 0.75 | NCF1 (0.54) | CYP1A2CYP2C19ALDH1A1HPGDHSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0737671-B1 | Aromatic hydroxamic acid compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2001-12-12 | — | — | EP | disclosed |
| US-5804601-A | USEFUL FOR TREATING ALZHEIMER'S DISEASE, MULTIPLE SCLEROSIS, BACTERIAL OR VIRAL MENINGITIS, DOWN'S SYNDROME AND PARKINSON'S DISEASE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-09-08 | — | — | US | disclosed |
| EP-0737671-A2 | Aromatic hydroxamic acid compounds, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1996-10-16 | — | — | EP | disclosed |