Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.54 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | USP5 | P45974 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | SLC18A3 | Q16572 | 3/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | FABP4 | P15090 | 1/20 | 0.39 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8533440 | 1.00 | AKR1C3 (0.54) | AKR1C3AKR1C1NPC1RAB9AUSP5 | |
| SCHEMBL8534117 | 0.87 | AKR1C3 (0.51) | AKR1C3AKR1C1NPC1RAB9ASIGMAR1 | |
| SCHEMBL8534118 | 0.87 | AKR1C3 (0.51) | AKR1C3AKR1C1NPC1RAB9ASIGMAR1 | |
| SCHEMBL6663660 | 0.85 | AKR1C3 (0.53) | AKR1C3AKR1C1NPC1RAB9ASIGMAR1 | |
| SCHEMBL6663656 | 0.85 | AKR1C3 (0.53) | AKR1C3AKR1C1NPC1RAB9ASIGMAR1 | |
| SCHEMBL2977549 | 0.82 | AKR1C3 (0.58) | AKR1C3AKR1C1NPC1RAB9ASIGMAR1 | |
| SCHEMBL31683804 | 0.82 | AKR1C3 (0.58) | AKR1C3AKR1C1NPC1RAB9ASIGMAR1 | |
| SCHEMBL21094209 | 0.82 | AKR1C3 (0.58) | AKR1C3AKR1C1NPC1RAB9ASIGMAR1 | |
| SCHEMBL1838140 | 0.81 | AKR1C3 (0.56) | AKR1C3AKR1C1NPC1RAB9ASIGMAR1 | |
| SCHEMBL3220689 | 0.81 | AKR1C3 (0.56) | AKR1C3AKR1C1NPC1RAB9ASIGMAR1 |
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-0885869-A1 | THERAPEUTIC AGENT FOR DIABETES | Japan Tobacco Inc. (JP) | 1998-12-23 | — | — | EP | claimed |
| EP-0885869-A1 | THERAPEUTIC AGENT FOR DIABETES | Japan Tobacco Inc. (JP) | 1998-12-23 | — | — | EP | disclosed |