Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 2/20 | 0.55 |
| ▸ | CASP1 | P29466 | 1/20 | 0.55 |
| ▸ | CASP2 | P42575 | 1/20 | 0.55 |
| ▸ | CASP7 | P55210 | 1/20 | 0.55 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.55 |
| ▸ | FOLH1 | Q04609 | 7/20 | 0.53 |
| ▸ | MAFG | O15525 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.52 |
| ▸ | CAPN1 | P07384 | 2/20 | 0.52 |
| ▸ | CNR1 | P21554 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ABL1 | P00519 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | IDE | P14735 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | PLG | P00747 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2037323 | 0.95 | TDP1 (0.51) | CASP3CASP1CASP2CASP7CASP8 | |
| SCHEMBL5406043 | 0.88 | TDP1 (0.56) | CASP3CASP1CASP2CASP7CASP8 | |
| SCHEMBL8219653 | 0.87 | CASP3 (0.53) | CASP3CASP1CASP2CASP7CASP8 | |
| SCHEMBL6534718 | 0.80 | MAFG (0.38) | CASP3CASP1CASP2CASP7CASP8 | |
| SCHEMBL7577396 | 0.80 | TDP1 (0.64) | CASP3CASP1CASP2CASP7CASP8 | |
| SCHEMBL29802482 | 0.78 | TDP1 (0.53) | CASP3CASP1CASP2CASP7CASP8 | |
| SCHEMBL29946177 | 0.78 | TDP1 (0.53) | CASP3CASP1CASP2CASP7CASP8 | |
| SCHEMBL25417015 | 0.77 | TDP1 (0.77) | FOLH1TDP1CAPN1MEN1ABL1 | |
| SCHEMBL12551857 | 0.77 | TDP1 (0.77) | FOLH1TDP1CAPN1MEN1ABL1 | |
| SCHEMBL16913029 | 0.77 | TDP1 (0.77) | FOLH1TDP1CAPN1MEN1ABL1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0822983-A4 | APOPAIN | MERCK & CO INC (US) | 2004-12-15 | — | — | EP | disclosed |
| EP-0822983-A1 | APOPAIN | Merck & Co., Inc. (US) | 1998-02-11 | — | — | EP | disclosed |
| WO-1996033268-A1 | APOPAIN | MERCK & CO., INC. (US) | 1996-10-24 | — | — | WO | disclosed |