Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 17/20 | 0.61 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.61 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.61 |
| ▸ | MMP2 | P08253 | 1/20 | 0.57 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.57 |
| ▸ | AKR1C2 | P52895 | 14/20 | 0.57 |
| ▸ | AKR1C4 | P17516 | 3/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL6706139 | 1.00 | AKR1C3 (0.61) | AKR1C3AKR1B10AKR1B1MMP2PAK1 | |
| SCHEMBL30659497 | 0.87 | HDAC3 (0.57) | AKR1C3AKR1B10AKR1B1AKR1C2AKR1C4 | |
| SCHEMBL28835913 | 0.83 | AKR1C3 (0.69) | AKR1C3AKR1B10AKR1B1MMP2PAK1 | |
| SCHEMBL69146 | 0.81 | NPSR1 (0.74) | AKR1C3AKR1B10AKR1B1MMP2AKR1C2 | |
| SCHEMBL271386 | 0.81 | NPSR1 (0.74) | AKR1C3AKR1B10AKR1B1MMP2AKR1C2 | |
| SCHEMBL3627671 | 0.81 | LTB4R (0.60) | AKR1C3AKR1B10AKR1B1MMP2KDM4E | |
| SCHEMBL5707226 | 0.81 | KDM4E (0.56) | AKR1C3AKR1B10AKR1B1MMP2AKR1C2 | |
| SCHEMBL3627668 | 0.81 | LTB4R (0.60) | AKR1C3AKR1B10AKR1B1MMP2KDM4E | |
| SCHEMBL17083115 | 0.80 | KDM4E (0.62) | AKR1C3AKR1B10AKR1B1MMP2KDM4E | |
| SCHEMBL9454262 | 0.80 | MAOA (0.42) | AKR1C3AKR1B10AKR1B1MMP2PAK1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2004026760-A | APOPTOSIS-INDUCING AGENT OF CANCER CELL, METHOD FOR PRODUCING THE SAME, ANTICANCER AGENT CONTAINING THE SAME AS ACTIVE INGREDIENT, FOOD PREPARATION AND COSMETIC | API CO LTD | 2004-01-29 | — | — | JP | disclosed |