Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.42 |
| ▸ | CFTR | P13569 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | PRKCZ | Q05513 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | GAA | P10253 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL773070 | 0.83 | ALDH1A1 (0.46) | ALDH1A1HSD17B10CFTRCA12CA1 | |
| SCHEMBL7461675 | 0.81 | ALDH1A1 (0.44) | ALDH1A1HSD17B10CFTRCA12CA1 | |
| SCHEMBL8178102 | 0.81 | ALDH1A1 (0.41) | ALDH1A1HSD17B10CFTRCA12CA1 | |
| SCHEMBL29284888 | 0.80 | CA12 (0.57) | ALDH1A1HSD17B10CA12CA1CA2 | |
| SCHEMBL3104246 | 0.79 | KDM4E (0.41) | ALDH1A1MAPTKDM4ETSHRCYP3A4 | |
| SCHEMBL1335494 | 0.79 | GRM6 (0.42) | ALDH1A1HSD17B10CFTRCA12CA1 | |
| SCHEMBL3530996 | 0.79 | ALDH1A1 (0.42) | ALDH1A1HSD17B10CFTRCA12CA1 | |
| SCHEMBL27474595 | 0.79 | ABL1 (0.45) | ALDH1A1HSD17B10CFTRCA12CA1 | |
| SCHEMBL9447396 | 0.79 | GRM6 (0.42) | ALDH1A1HSD17B10CFTRCA12CA1 | |
| SCHEMBL16096788 | 0.79 | NCEH1 (0.42) | ALDH1A1HSD17B10CA12CA1CA2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1335307-A | Synthesis process of 2-amino quinbolone compounds | MILITARY MEDICAL UNIV NO 1 PLA (CN) | 2002-02-13 | — | — | CN | disclosed |
| EP-0637300-B1 | ANTIPROLIFERATIVE QUINAZOLINES | AGOURON PHARMA (US) | 2001-09-05 | — | — | EP | disclosed |
| EP-0637300-A1 | ANTIPROLIFERATIVE QUINAZOLINES | AGOURON PHARMACEUTICALS, INC. (US) | 1995-02-08 | — | — | EP | disclosed |
| WO-1993020055-A1 | ANTIPROLIFERATIVE QUINAZOLINES | AGOURON PHARMACEUTICALS, INC. (US) | 1993-10-14 | — | — | WO | disclosed |