Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 4/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | GLA | P06280 | 3/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | CASP1 | P29466 | 2/20 | 0.52 |
| ▸ | CASP7 | P55210 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | MAOA | P21397 | 2/20 | 0.52 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.52 |
| ▸ | NQO2 | P16083 | 1/20 | 0.52 |
| ▸ | DRD1 | P21728 | 1/20 | 0.52 |
| ▸ | ACHE | P22303 | 1/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL3042274 | 0.96 | ERN1 (0.61) | ERN1KDM4EALDH1A1GLAHPGD | |
| SCHEMBL5852389 | 0.80 | ERN1 (0.55) | ERN1KDM4EALDH1A1HSD17B10MAOA | |
| SCHEMBL6646525 | 0.77 | ERN1 (0.49) | ERN1ALDH1A1SMN1; SMN2HSD17B10MAOA | |
| Benzene SCHEMBL27502416 | 0.76 | ERN1 (0.51) | ERN1KDM4EALDH1A1SMN1; SMN2MAOA | |
| SCHEMBL20659678 | 0.76 | ERN1 (0.70) | ERN1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL9364466 | 0.76 | ERN1 (0.51) | ERN1KDM4EALDH1A1GLAHPGD | |
| Hydrazine SCHEMBL27777113 | 0.76 | POLB (0.50) | ERN1KDM4EALDH1A1SMN1; SMN2ADORA3 | |
| SCHEMBL11873676 | 0.76 | ERN1 (0.48) | ERN1ALDH1A1CASP1CASP7SMN1; SMN2 | |
| SCHEMBL13271201 | 0.76 | ERN1 (0.55) | ERN1KDM4EALDH1A1HPGDRAB9A | |
| SCHEMBL13313363 | 0.76 | CYP1A2 (0.58) | ERN1KDM4EALDH1A1HPGDNQO2 |
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-104262331-B | A kind of acridine acylhydrazone and its production and use | 广西中医药大学 | 2016-07-06 | — | — | CN | claimed |
| CN-104262331-B | A kind of acridine acylhydrazone and its production and use | 广西中医药大学 | 2016-07-06 | — | — | CN | disclosed |