Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | MMP7 | P09237 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | MMP8 | P22894 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | BCAT2 | O15382 | 2/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | NQO2 | P16083 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.36 |
| ▸ | DHODH | Q02127 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19661323 | 0.85 | MMP1 (0.42) | MMP1MMP7MMP9MMP8MMP13 | |
| SCHEMBL1126731 | 0.84 | MMP1 (0.41) | MMP1MMP7MMP9MMP8MMP13 | |
| SCHEMBL31585835 | 0.81 | GABRA1 (0.45) | MMP1MMP7MMP9MMP8MMP13 | |
| SCHEMBL1127123 | 0.80 | ALDH1A1 (0.40) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL4432353 | 0.78 | SMN1; SMN2 (0.44) | SMN1; SMN2BCAT2THRBHSD17B10BRD4 | |
| SCHEMBL24584804 | 0.77 | CES2 (0.51) | MMP1MMP7MMP9MMP8MMP13 | |
| SCHEMBL31585967 | 0.76 | SMN1; SMN2 (0.39) | MMP1MMP7MMP9MMP8MMP13 | |
| SCHEMBL31585904 | 0.75 | MMP1 (0.40) | MMP1MMP7MMP9MMP8MMP13 | |
| SCHEMBL28643713 | 0.75 | ALDH1A1 (0.51) | SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL16500243 | 0.75 | MEN1 (0.37) | SMN1; SMN2GABRA1GABRG2GABRB3GABRA3 |
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-116675704-A | Pyrrole derivative and preparation method and application thereof | 深圳市祥根生物医药有限公司 | 2023-09-01 | — | — | CN | disclosed |
| CN-114644634-B | Pyrrole derivative and preparation method and application thereof | 深圳市祥根生物医药有限公司 | 2023-06-20 | — | — | CN | disclosed |
| WO-2022134837-A1 | PYRROLE DERIVATIVE, AND PREPARATION METHOD AND USE THEREFOR | 深圳市祥根生物医药有限公司 | 2022-06-30 | — | — | WO | disclosed |
| CN-114644634-A | Pyrrole derivative and preparation method and application thereof | 深圳市祥根生物医药有限公司 | 2022-06-21 | — | — | CN | disclosed |