Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 3/20 | 0.53 |
| ▸ | CTSS | P25774 | 1/20 | 0.49 |
| ▸ | CTSK | P43235 | 1/20 | 0.49 |
| ▸ | F11 | P03951 | 8/20 | 0.48 |
| ▸ | MMP2 | P08253 | 2/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | LEF1 | Q9UJU2 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | CTNNB1 | P35222 | 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 | |
|---|---|---|---|---|
| SCHEMBL28746481 | 0.92 | MMP13 (0.53) | MMP13CTSSCTSKF11MMP2 | |
| SCHEMBL28746480 | 0.92 | MMP13 (0.53) | MMP13CTSSCTSKF11MMP2 | |
| SCHEMBL23466603 | 0.92 | MMP13 (0.55) | MMP13CTSSCTSKF11MMP2 | |
| SCHEMBL29758100 | 0.92 | MMP13 (0.55) | MMP13CTSSCTSKF11MMP2 | |
| SCHEMBL23466599 | 0.92 | MMP13 (0.55) | MMP13CTSSCTSKF11MMP2 | |
| SCHEMBL28746506 | 0.90 | MMP13 (0.52) | MMP13CTSSCTSKF11MMP2 | |
| SCHEMBL28746504 | 0.90 | MMP13 (0.52) | MMP13CTSSCTSKF11MMP2 | |
| SCHEMBL28919287 | 0.90 | F11 (0.55) | CTSSCTSKF11HDAC8 | |
| SCHEMBL28602428 | 0.90 | F11 (0.55) | CTSSCTSKF11HDAC8 | |
| SCHEMBL28746519 | 0.89 | MMP13 (0.50) | MMP13F11MMP2HDAC8KDM4E |
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 |