Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | NAALAD2 | Q9Y3Q0 | 1/20 | 0.37 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | GGH | Q92820 | 1/20 | 0.34 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.32 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.31 |
| ▸ | GPR84 | Q9NQS5 | 6/20 | 0.31 |
| ▸ | PPARG | P37231 | 6/20 | 0.31 |
| ▸ | PPARD | Q03181 | 6/20 | 0.31 |
| ▸ | PPARA | Q07869 | 6/20 | 0.31 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.31 |
| ▸ | TSHR | P16473 | 4/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20382398 | 0.88 | ALDH1A1 (0.47) | ALDH1A1MEN1KMT2ACYP1A2THRB | |
| SCHEMBL25991264 | 0.86 | ALDH1A1 (0.37) | ALDH1A1MEN1KMT2ACYP1A2THRB | |
| SCHEMBL9495952 | 0.79 | MEN1 (0.39) | ALDH1A1MEN1KMT2ACYP1A2THRB | |
| SCHEMBL11299591 | 0.76 | FDPS (0.44) | ALDH1A1MEN1KMT2AAKR1B1GPR84 | |
| Butane SCHEMBL27837597 | 0.76 | MEN1 (0.39) | ALDH1A1MEN1KMT2ACYP1A2THRB | |
| SCHEMBL22514 | 0.73 | ALDH1A1 (0.35) | ALDH1A1MEN1KMT2ACYP1A2THRB | |
| SCHEMBL3382753 | 0.73 | NAALAD2 (0.42) | ALDH1A1MEN1KMT2ACYP1A2THRB | |
| SCHEMBL282438 | 0.73 | FDPS (0.37) | ALDH1A1MEN1KMT2ACYP1A2THRB | |
| SCHEMBL2991452 | 0.73 | GRM2 (0.32) | ALDH1A1MEN1KMT2ACYP1A2THRB | |
| SCHEMBL25187865 | 0.72 | ALDH1A1 (0.34) | ALDH1A1MEN1KMT2ACYP1A2THRB |
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-0994707-A4 | INHIBITORS OF NAALADASE ENZYME ACTIVITY | GUILFORD PHARM INC (US) | 2001-11-14 | — | — | EP | disclosed |
| EP-0994707-A1 | INHIBITORS OF NAALADASE ENZYME ACTIVITY | GUILFORD PHARMACEUTICALS INC. (US) | 2000-04-26 | — | — | EP | disclosed |
| WO-1998053812-A1 | INHIBITORS OF NAALADASE ENZYME ACTIVITY | GUILFORD PHARMACEUTICALS INC. (US) | 1998-12-03 | — | — | WO | disclosed |