Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD74 | P04233 | 1/20 | 0.49 |
| ▸ | MIF | P14174 | 1/20 | 0.49 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.46 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.45 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.44 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.43 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.43 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | ADCY10 | Q96PN6 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22953708 | 0.88 | CD74 (0.52) | CD74MIFABHD6SLC7A5LOXL2 | |
| SCHEMBL22953220 | 0.87 | CD74 (0.46) | CD74MIFABHD6SLC7A5LOXL2 | |
| SCHEMBL28521863 | 0.85 | AADAT (0.54) | CD74MIFKDM4EMAPTMEN1 | |
| SCHEMBL28525980 | 0.81 | PARP1 (0.39) | KDM4EL3MBTL1ALDH1A1KMT2AHSD17B10 | |
| SCHEMBL28687357 | 0.81 | L3MBTL1 (0.46) | KDM4EL3MBTL1ALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL28511332 | 0.81 | NAMPT (0.45) | KDM4EMAPTL3MBTL1ALDH1A1 | |
| SCHEMBL28507281 | 0.81 | ALDH1A1 (0.47) | KDM4EMAPTL3MBTL1MEN1ALDH1A1 | |
| SCHEMBL28528135 | 0.78 | AADAT (0.51) | MAPTL3MBTL1MEN1ALDH1A1KMT2A | |
| SCHEMBL29774650 | 0.77 | ALDH1A1 (0.43) | KDM4EMAPTL3MBTL1MEN1ALDH1A1 | |
| SCHEMBL28531542 | 0.77 | ALDH1A1 (0.43) | KDM4EMAPTL3MBTL1MEN1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112300169-B | Pyrrolopyrazole derivative, preparation method and medical application thereof | 上海美迪西生物医药股份有限公司 | 2022-03-04 | — | — | CN | disclosed |
| CN-112300169-A | Pyrrolopyrazole derivative, preparation method and medical application thereof | 上海美迪西生物医药股份有限公司 | 2021-02-02 | — | — | CN | disclosed |