Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGDS | O60760 | 1/20 | 0.54 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.46 |
| ▸ | PIN1 | Q13526 | 4/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CLK1 | P49759 | 1/20 | 0.41 |
| ▸ | CLK2 | P49760 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2097494 | 1.00 | HPGDS (0.54) | HPGDSPTPN1PIN1SMN1; SMN2RAB9A | |
| SCHEMBL1121702 | 0.87 | NPC1 (0.55) | HPGDSPTPN1SMN1; SMN2RAB9ANPC1 | |
| SCHEMBL30620888 | 0.85 | HMGCR (0.53) | PIN1SMN1; SMN2RAB9ANPC1PKM | |
| SCHEMBL9720553 | 0.85 | HMGCR (0.53) | PIN1SMN1; SMN2RAB9ANPC1PKM | |
| SCHEMBL5023065 | 0.84 | MRGPRX1 (0.47) | HPGDSPTPN1SMN1; SMN2PKMMAPT | |
| SCHEMBL23116699 | 0.83 | PIN1 (0.45) | PIN1SMN1; SMN2RAB9ANPC1PKM | |
| SCHEMBL20855539 | 0.83 | KMT2A (0.48) | PIN1SMN1; SMN2RAB9ANPC1PKM | |
| SCHEMBL2096737 | 0.83 | HPGDS (0.57) | HPGDSSMN1; SMN2LMNAGSK3BMEN1 | |
| SCHEMBL29622845 | 0.82 | KEAP1 (0.53) | PIN1SMN1; SMN2RAB9ANPC1PKM | |
| SCHEMBL113562 | 0.82 | KEAP1 (0.53) | PIN1SMN1; SMN2RAB9ANPC1PKM |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118930487-A | 1,3, 5-Trisubstituted pyrazole compound and preparation method thereof | 赣南师范大学 | 2024-11-12 | — | — | CN | claimed |
| CN-118930487-A | 1,3, 5-Trisubstituted pyrazole compound and preparation method thereof | 赣南师范大学 | 2024-11-12 | — | — | CN | disclosed |
| WO-2023017699-A1 | 3-SUBSTITUTED URACIL COMPOUND, AGRICULTURAL AND HORTICULTURAL GERMICIDE, NEMATICIDE, AND MEDICAL AND ANIMAL ANTIFUNGAL AGENT | 日本曹達株式会社 | 2023-02-16 | — | — | WO | disclosed |
| CN-114585610-A | 2, 6-dioxo-3, 6-dihydropyrimidine compound, and agricultural and horticultural bactericide, nematicide, and medical and animal antifungal agent | 日本曹达株式会社 | 2022-06-03 | — | — | CN | disclosed |