Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B3 | P37058 | 8/20 | 1.00 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 1.00 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 1.00 |
| ▸ | CA12 | O43570 | 6/20 | 1.00 |
| ▸ | CA9 | Q16790 | 6/20 | 1.00 |
| ▸ | HPGD | P15428 | 4/20 | 1.00 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 1.00 |
| ▸ | GAA | P10253 | 4/20 | 1.00 |
| ▸ | GLA | P06280 | 3/20 | 1.00 |
| ▸ | AKR1B1 | P15121 | 3/20 | 1.00 |
| ▸ | MAOB | P27338 | 3/20 | 1.00 |
| ▸ | CASP1 | P29466 | 2/20 | 1.00 |
| ▸ | CASP7 | P55210 | 2/20 | 1.00 |
| ▸ | MCL1 | Q07820 | 2/20 | 1.00 |
| ▸ | LMNA | P02545 | 1/20 | 1.00 |
| ▸ | CYP1A2 | P05177 | 1/20 | 1.00 |
| ▸ | CYP2C9 | P11712 | 1/20 | 1.00 |
| ▸ | UGT1A1 | P22309 | 1/20 | 1.00 |
| ▸ | KDR | P35968 | 1/20 | 1.00 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.69 |
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 | |
|---|---|---|---|---|
| Hymecromone SCHEMBL29364837 | 1.00 | HSD17B3 (1.00) | HSD17B3ALDH1A1KDM4ECA12CA9 | |
| Hymecromone SCHEMBL29624431 | 1.00 | HSD17B3 (1.00) | HSD17B3ALDH1A1KDM4ECA12CA9 | |
| Hymecromone SCHEMBL24150 | 1.00 | HSD17B3 (1.00) | HSD17B3ALDH1A1KDM4ECA12CA9 | |
| Hymecromone SCHEMBL31014 | 0.98 | HSD17B3 (0.96) | HSD17B3ALDH1A1KDM4ECA12CA9 | |
| Hymecromone SCHEMBL27924142 | 0.98 | HSD17B3 (0.96) | HSD17B3ALDH1A1KDM4ECA12CA9 | |
| Hymecromone SCHEMBL27728511 | 0.96 | HSD17B3 (0.93) | HSD17B3ALDH1A1KDM4ECA12CA9 | |
| Hymecromone SCHEMBL2256610 | 0.95 | ALDH1A1 (0.90) | HSD17B3ALDH1A1KDM4ECA12CA9 | |
| Hymecromone SCHEMBL28882003 | 0.93 | KDM4E (0.87) | HSD17B3ALDH1A1KDM4ECA12CA9 | |
| Hymecromone SCHEMBL3272842 | 0.93 | HSD17B3 (0.87) | HSD17B3ALDH1A1KDM4ECA12CA9 | |
| Hymecromone SCHEMBL7594956 | 0.93 | KDM4E (0.87) | HSD17B3ALDH1A1KDM4ECA12CA9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117940444-A | Caspase-2 inhibitor compounds | 金特速吉医疗有限责任公司 | 2024-04-26 | — | — | CN | disclosed |
| WO-2011087711-A1 | METHODS OF DETECTING MICROORGANISMS AND KITS THEREFORE | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2011-07-21 | — | — | WO | disclosed |
| US-5686243-A | DETECTING POLYNUCLEOTIDE SEQUENCES; HYBRIDIZATION | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1997-11-11 | — | — | US | disclosed |