Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | PRNP | P04156 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.42 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.39 |
| ▸ | PARP1 | P09874 | 2/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1193984 | 0.74 | ALDH1A1 (0.59) | ALDH1A1HPGDMAPTPRNPHTT | |
| Quinazolinone SCHEMBL10418 | 0.74 | PARP1 (0.48) | ALDH1A1HPGDMAPTPRNPHTT | |
| Quinazolinone SCHEMBL8201415 | 0.72 | PARP1 (0.47) | ALDH1A1HPGDMAPTPRNPHTT | |
| Quinazolinone SCHEMBL7746268 | 0.72 | PARP1 (0.47) | ALDH1A1HPGDMAPTPRNPHTT | |
| Quinazolinone SCHEMBL7744396 | 0.71 | PARP1 (0.46) | ALDH1A1HPGDMAPTPRNPHTT | |
| Benzimidazole SCHEMBL29358377 | 0.67 | — | — | |
| Benzimidazole SCHEMBL6009 | 0.67 | — | — | |
| Benzimidazole SCHEMBL29408372 | 0.67 | — | — | |
| Benzimidazole SCHEMBL461969 | 0.67 | SMN1; SMN2 (0.50) | ALDH1A1HPGDMAPTHTTSMN1; SMN2 | |
| Benzimidazole SCHEMBL10931770 | 0.67 | SMN1; SMN2 (0.50) | ALDH1A1HPGDMAPTHTTSMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2007001910-A | OPTICALLY RECORDING MEDIUM AND QUINAZOLIN-4-YLIDENEAMINE DERIVATIVE | MITSUI CHEMICALS INC | 2007-01-11 | — | — | JP | disclosed |
| EP-0227451-A2 | 5,6-Dialkoxy-4-imino-2 (1H)quinazolinone derivatives | ORTHO PHARMACEUTICAL CORPORATION (US) | 1987-07-01 | — | — | EP | disclosed |
| US-4668787-A | CARDIOTONIC | ORTHO PHARMACEUTICAL CORPORATION (US) | 1987-05-26 | — | — | US | disclosed |