Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.49 |
| ▸ | GAA | P10253 | 4/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | CTSD | P07339 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | CFTR | P13569 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | CASP3 | P42574 | 1/20 | 0.44 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.44 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.44 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.44 |
| ▸ | FADS1 | O60427 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL112991 | 0.87 | ALDH1A1 (0.55) | ALDH1A1GAAKDM4EMAPTHPGD | |
| SCHEMBL4955428 | 0.79 | ALDH1A1 (0.59) | ALDH1A1KDM4EHPGDCA1CA2 | |
| Succinic Acid SCHEMBL10615249 | 0.79 | KDM4E (0.55) | ALDH1A1GAAKDM4EMAPTHPGD | |
| SCHEMBL7336041 | 0.78 | NR4A2 (0.55) | ALDH1A1GAACYP2C19KDM4EMAPT | |
| SCHEMBL4953682 | 0.77 | MEN1 (0.57) | ALDH1A1KDM4EHPGDKMT2AMEN1 | |
| Succinic Acid SCHEMBL6544851 | 0.77 | NR4A2 (0.56) | ALDH1A1GAACYP2C19MAPTHDAC1 | |
| SCHEMBL11312539 | 0.76 | NPC1 (0.62) | ALDH1A1GAACYP2C19KDM4EHDAC1 | |
| SCHEMBL31267447 | 0.76 | ALDH1A1 (0.68) | ALDH1A1KDM4EHPGDHSD17B10CFTR | |
| Octanedioate SCHEMBL15255207 | 0.76 | ALDH1A1 (0.49) | ALDH1A1KDM4EHDAC1HPGDHSD17B10 | |
| SCHEMBL4955604 | 0.76 | MAPK1 (0.57) | ALDH1A1KDM4EHDAC1HPGDKMT2A |
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-107698599-A | The synthesis of pyridazine simultaneously [6,1 b] pyrrolo- [1,2 a] Quinazol derivative | 江苏徐淮地区徐州农业科学研究所(江苏徐州甘薯研究中心) | 2018-02-16 | — | — | CN | disclosed |