Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 1/20 | 0.44 |
| ▸ | APP | P05067 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 7/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3565159 | 1.00 | CASP3 (0.44) | CASP3APPKMT2AMEN1MAPT | |
| SCHEMBL3563637 | 0.88 | APP (0.50) | CASP3APPMAPTALDH1A1KDM4E | |
| SCHEMBL3563633 | 0.88 | APP (0.50) | CASP3APPMAPTALDH1A1KDM4E | |
| SCHEMBL3576527 | 0.80 | MEN1 (0.57) | CASP3KMT2AMEN1ALDH1A1KDM4E | |
| SCHEMBL3576525 | 0.80 | MEN1 (0.57) | CASP3KMT2AMEN1ALDH1A1KDM4E | |
| SCHEMBL3566377 | 0.79 | KDM4E (0.44) | ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL3566379 | 0.79 | KDM4E (0.44) | ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL3573931 | 0.77 | PPOX (0.46) | CASP3KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL3573929 | 0.77 | PPOX (0.46) | CASP3KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL3565087 | 0.75 | CASP3 (0.45) | CASP3APPKMT2AMEN1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-7713994-B2 | Substituted isoquinoline-1,3(2H,4H)-diones, 1-thioxo,1,4-dihydro-2H-isoquinoline-3-ones and 1,4-dihyro-3 (2H)-isoquinolones and methods of use thereof | WYETH LLC (US) | 2010-05-11 | — | — | US | claimed |