Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 12/20 | 0.54 |
| ▸ | PARP10 | Q53GL7 | 5/20 | 0.44 |
| ▸ | PARP15 | Q460N3 | 3/20 | 0.44 |
| ▸ | PARP14 | Q460N5 | 2/20 | 0.44 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.44 |
| ▸ | TNKS | O95271 | 1/20 | 0.44 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.44 |
| ▸ | PLAU | P00749 | 2/20 | 0.41 |
| ▸ | PLAT | P00750 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL14743718 | 0.83 | TSHR (0.41) | PARP1TSHRPOLB | |
| SCHEMBL29503148 | 0.80 | PARP1 (0.55) | PARP1PARP10PARP15PARP14PARP2 | |
| SCHEMBL31019778 | 0.74 | ALDH1A1 (0.45) | CYP3A4RECQLTDP1CA1CA2 | |
| SCHEMBL31021028 | 0.72 | PARP1 (0.73) | PARP1PARP10PARP15PARP14PARP2 | |
| SCHEMBL36694 | 0.72 | PARP1 (0.73) | PARP1PARP10PARP15PARP14PARP2 | |
| SCHEMBL12230060 | 0.72 | ACHE (0.44) | TDP1L3MBTL1CA1CA2 | |
| SCHEMBL12230075 | 0.71 | ACHE (0.40) | CYP1A2POLBCYP3A4MAPTBLM | |
| SCHEMBL283787 | 0.71 | PARP1 (1.00) | PARP1PARP10PARP15PARP14PARP2 | |
| SCHEMBL2490695 | 0.71 | PARP1 (0.61) | PARP1PLAUPLATTSHRPOLB | |
| SCHEMBL12230058 | 0.71 | ALDH1A1 (0.40) | PARP1CYP1A2CYP3A4MAPTCYP2C19 |
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-116715625-A | Heteroaryl compounds as protein kinase inhibitors | 福建海西新药创制股份有限公司 | 2023-09-08 | — | — | CN | disclosed |