Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28594082 | 0.86 | HTT (0.65) | MEN1KMT2ASMN1; SMN2HTTNPC1 | |
| SCHEMBL28597446 | 0.85 | RAB9A (0.49) | MEN1KMT2ASMN1; SMN2HTTRAB9A | |
| SCHEMBL27706292 | 0.79 | CES2 (0.46) | MEN1KMT2ASMN1; SMN2EPHX1NPC1 | |
| SCHEMBL28608998 | 0.76 | HTT (0.53) | MEN1KMT2ASMN1; SMN2HTTTDP1 | |
| SCHEMBL197282 | 0.74 | SMN1; SMN2 (0.67) | MEN1KMT2ASMN1; SMN2HTTEPHX1 | |
| SCHEMBL4743252 | 0.73 | ALDH1A1 (0.70) | MEN1KMT2ASMN1; SMN2HTTEPHX1 | |
| SCHEMBL11311428 | 0.73 | HTT (0.50) | MEN1KMT2ASMN1; SMN2HTTMAPT | |
| Hydrochloric Acid SCHEMBL9486219 | 0.73 | SMN1; SMN2 (0.64) | MEN1KMT2ASMN1; SMN2HTTEPHX1 | |
| Methane SCHEMBL27454317 | 0.73 | SMN1; SMN2 (0.64) | MEN1KMT2ASMN1; SMN2HTTEPHX1 | |
| SCHEMBL27813922 | 0.72 | SMN1; SMN2 (0.44) | MEN1KMT2ASMN1; SMN2NPC1RAB9A |
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-108456157-B | 1-substituted benzoyl-4-fatty acyl semicarbazide derivatives, preparation method and application as antibacterial drugs | 中国医学科学院药物研究所 | 2021-07-20 | — | — | CN | disclosed |