Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | CNR2 | P34972 | 2/20 | 0.50 |
| ▸ | CNR1 | P21554 | 3/20 | 0.48 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.48 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.46 |
| ▸ | CDC7 | O00311 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | AKT1 | P31749 | 1/20 | 0.42 |
| ▸ | AKT2 | P31751 | 1/20 | 0.42 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 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 | |
|---|---|---|---|---|
| SCHEMBL8946447 | 0.99 | ALDH1A1 (0.54) | ALDH1A1CNR2CNR1PTPN11MAPK8 | |
| SCHEMBL4120279 | 0.88 | ALDH1A1 (0.45) | ALDH1A1PTPN11KDM4EMEN1MAPT | |
| SCHEMBL2954462 | 0.88 | PTPN11 (0.52) | ALDH1A1CNR2PTPN11POLBSMN1; SMN2 | |
| SCHEMBL4112070 | 0.88 | HRH4 (0.49) | ALDH1A1CNR2PTPN11KDM4EMAPT | |
| Piperazine SCHEMBL6016442 | 0.87 | ALDH1A1 (0.44) | ALDH1A1PTPN11KDM4EMEN1MAPT | |
| SCHEMBL6016426 | 0.83 | PTPN11 (0.53) | ALDH1A1CNR1PTPN11MAPK8CDC7 | |
| Methylpiperazine SCHEMBL6016601 | 0.82 | HRH4 (0.44) | ALDH1A1CNR2PTPN11KDM4EMAPT | |
| Morpholine SCHEMBL6016373 | 0.82 | PIK3CA (0.47) | ALDH1A1CNR2PTPN11POLBSMN1; SMN2 | |
| SCHEMBL8267708 | 0.82 | GPBAR1 (0.43) | ALDH1A1CNR2CNR1PTPN11POLB | |
| Hydrochloric Acid SCHEMBL3866277 | 0.82 | PTPN11 (0.52) | ALDH1A1CNR1PTPN11MAPK8CDC7 |
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 |
|---|---|---|---|---|---|---|---|
| US-5500424-A | ENZYME INHIBITORS | NIHON NOHYAKU CO., LTD. (JP) | 1996-03-19 | — | — | US | disclosed |
| EP-0638557-A1 | N-phenylpyri(mi)dine-N'-phenyl-urea derivatives, their preparation and their use as ACAT inhibitors | NIHON NOHYAKU CO., LTD. (JP) | 1995-02-15 | — | — | EP | disclosed |