Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 9/20 | 0.46 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | DAO | P14920 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL10743236 | 0.74 | PARP1 (0.63) | PARP1ARALDH1A1LMNACYP2C9 | |
| SCHEMBL24194274 | 0.68 | SMN1; SMN2 (0.52) | PARP1ALDH1A1SMN1; SMN2LMNAHPGD | |
| SCHEMBL6385502 | 0.68 | SMN1; SMN2 (0.52) | ALDH1A1SMN1; SMN2TSHRLMNAHPGD | |
| SCHEMBL16112290 | 0.67 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2LMNAHPGDCYP1A2 | |
| SCHEMBL4255989 | 0.67 | NPBWR1 (0.51) | ALDH1A1SMN1; SMN2LMNAPOLBCYP1A2 | |
| SCHEMBL25546738 | 0.66 | PARP1 (0.71) | PARP1ARALDH1A1TSHRLMNA | |
| SCHEMBL25308925 | 0.65 | SMN1; SMN2 (0.55) | PARP1ARALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL5778710 | 0.65 | SMN1; SMN2 (0.52) | ALDH1A1SMN1; SMN2TSHRPOLBL3MBTL1 | |
| SCHEMBL2649963 | 0.64 | MEN1 (0.52) | ALDH1A1SMN1; SMN2TSHRLMNACYP2C9 | |
| SCHEMBL863462 | 0.64 | AR (1.00) | PARP1ARTSHRLMNACYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2046757-A1 | CASPASE INHIBITORS BASED ON PYRIDAZINONE SCAFFOLD | LG Life Sciences Ltd. (KR) | 2009-04-15 | — | — | EP | disclosed |
| WO-2008016239-A1 | CASPASE INHIBITORS BASED ON PYRIDAZINONE SCAFFOLD | LG LIFE SCIENCES LTD. (KR) | 2008-02-07 | — | — | WO | disclosed |