Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 8/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.43 |
| ▸ | HPGD | P15428 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.42 |
| ▸ | ATM | Q13315 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.42 |
| ▸ | KHK | P50053 | 4/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL25989988 | 0.75 | KHK (0.72) | HSD17B10MAPK1HPGDSMN1; SMN2KHK | |
| SCHEMBL22828651 | 0.73 | KHK (0.73) | HSD17B10MAPK1HPGDKDM4ECYP1A2 | |
| SCHEMBL30060444 | 0.70 | KDM4E (0.41) | HSD17B10MAPK1KDM4EALDH1A1KHK | |
| SCHEMBL22828663 | 0.67 | KHK (0.49) | KHK | |
| SCHEMBL17491485 | 0.66 | HPGD (0.43) | HSD17B10MAPK1HPGDKDM4EALDH1A1 | |
| SCHEMBL31039223 | 0.65 | NPBWR1 (0.44) | HSD17B10KDM4EALDH1A1KHK | |
| SCHEMBL25990345 | 0.64 | RBP4 (0.38) | HSD17B10MAPK1HPGDALDH1A1CYP1A2 | |
| SCHEMBL19098622 | 0.64 | KHK (0.80) | KHK | |
| SCHEMBL19099006 | 0.64 | KHK (0.80) | KHK | |
| SCHEMBL25242115 | 0.64 | HRH4 (0.43) | NPSR1KHK |
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 |
|---|---|---|---|---|---|---|---|
| EP-3983404-B1 | DISUBSTITUTED PYRAZOLE COMPOUNDS AS KETOHEXOKINASE INHBITORS | LILLY CO ELI (US) | 2023-08-09 | — | — | EP | disclosed |