Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.47 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.47 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL28294637 | 0.77 | ALDH1A1 (0.47) | KDM4EALDH1A1RAB9ATDP1HPGD | |
| SCHEMBL5401821 | 0.75 | KDM4E (0.56) | KDM4EALDH1A1RAB9ATDP1HPGD | |
| SCHEMBL28271026 | 0.73 | DRD2 (0.63) | KDM4EALDH1A1RAB9AHPGDMAPT | |
| SCHEMBL28296211 | 0.73 | KLKB1 (0.43) | RAB9AKLKB1POLB | |
| SCHEMBL28146146 | 0.72 | KLKB1 (0.46) | KDM4EALDH1A1HPGDMAPTLMNA | |
| SCHEMBL5403605 | 0.71 | KDM4E (0.56) | KDM4EALDH1A1RAB9ATDP1HPGD | |
| SCHEMBL201951 | 0.70 | KDM4E (0.70) | KDM4EALDH1A1RAB9ATDP1HPGD | |
| SCHEMBL202826 | 0.70 | KDM4E (0.70) | KDM4EALDH1A1RAB9ATDP1HPGD | |
| SCHEMBL3370261 | 0.70 | KDM4E (0.97) | KDM4EALDH1A1RAB9ATDP1HPGD | |
| SCHEMBL2096148 | 0.69 | MAPT (0.61) | KDM4EALDH1A1RAB9ATDP1HPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106608872-A | 5-pyrazole amide compound, and preparation method and application thereof | 湖南化工研究院有限公司 | 2017-05-03 | — | — | CN | disclosed |