Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | PARP1 | P09874 | 3/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
| ▸ | PRKCI | P41743 | 1/20 | 0.53 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.53 |
| ▸ | AR | P10275 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | KDM4A | O75164 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
| ▸ | TNKS | O95271 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TYMS | P04818 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL1008553 | 1.00 | ALDH1A1 (0.53) | ALDH1A1PARP1HSD17B10TDP1PRKCI | |
| SCHEMBL18333501 | 0.84 | ALDH1A1 (0.50) | ALDH1A1PARP1HSD17B10TDP1PRKCI | |
| SCHEMBL27251533 | 0.78 | HSD17B10 (0.50) | ALDH1A1PARP1HSD17B10TDP1PRKCI | |
| SCHEMBL29987827 | 0.77 | NOS1 (0.58) | ALDH1A1PARP1HSD17B10TDP1PRKCI | |
| SCHEMBL16098816 | 0.77 | NOS1 (0.58) | ALDH1A1PARP1HSD17B10TDP1PRKCI | |
| SCHEMBL30142230 | 0.77 | PARP1 (0.53) | ALDH1A1PARP1HSD17B10TDP1PRKCI | |
| SCHEMBL14911633 | 0.77 | NOS1 (0.58) | ALDH1A1PARP1HSD17B10TDP1PRKCI | |
| SCHEMBL1009337 | 0.77 | HSD17B10 (0.53) | ALDH1A1PARP1HSD17B10TDP1PRKCI | |
| SCHEMBL1261836 | 0.77 | PARP1 (0.53) | ALDH1A1PARP1HSD17B10TDP1PRKCI | |
| SCHEMBL29655001 | 0.77 | HSD17B10 (0.53) | ALDH1A1PARP1HSD17B10TDP1PRKCI |
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-118496166-A | Preparation method of phthalazinone compound | 五邑大学 | 2024-08-16 | — | — | CN | claimed |
| CN-118496166-A | Preparation method of phthalazinone compound | 五邑大学 | 2024-08-16 | — | — | CN | disclosed |