Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
| ▸ | APEX1 | P27695 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | F11 | P03951 | 12/20 | 0.51 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28291183 | 0.90 | ROCK2 (0.49) | KDM4EALDH1A1HPGDHSD17B10F11 | |
| SCHEMBL29121392 | 0.90 | ROCK2 (0.49) | KDM4EALDH1A1HPGDHSD17B10F11 | |
| Hydrochloric Acid SCHEMBL29757993 | 0.89 | ROCK2 (0.48) | KDM4EALDH1A1HPGDHSD17B10F11 | |
| Hydrochloric Acid SCHEMBL28974360 | 0.89 | ROCK2 (0.48) | KDM4EALDH1A1HPGDHSD17B10F11 | |
| Hydrochloric Acid SCHEMBL28974362 | 0.89 | ROCK2 (0.48) | KDM4EALDH1A1HPGDHSD17B10F11 | |
| SCHEMBL28599881 | 0.86 | MMP13 (0.64) | KDM4EALDH1A1LMNAHPGDHSD17B10 | |
| SCHEMBL28599879 | 0.86 | MMP13 (0.64) | KDM4EALDH1A1LMNAHPGDHSD17B10 | |
| SCHEMBL28292656 | 0.79 | ROCK2 (0.40) | F11RXFP1NPC1RAB9AMEN1 | |
| SCHEMBL28602428 | 0.79 | F11 (0.55) | F11 | |
| SCHEMBL28698876 | 0.78 | F11 (0.42) | KDM4EALDH1A1HPGDHSD17B10F11 |
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-109721539-B | Pyrazole amide derivative and preparation method and application thereof | 天津药物研究院有限公司 | 2021-07-09 | — | — | CN | disclosed |
| CN-109721539-A | Pyrazole amide analog derivative and its preparation method and application | 天津药物研究院有限公司 | 2019-05-07 | — | — | CN | disclosed |