Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | F10 | P00742 | 3/20 | 0.39 |
| ▸ | NOS2 | P35228 | 2/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL7377743 | 1.00 | KMT2A (0.43) | KMT2ACNR2TDP1CYP1A2ALDH1A1 | |
| SCHEMBL27339917 | 0.83 | CNR2 (0.43) | KMT2ACNR2TDP1CYP1A2ALDH1A1 | |
| SCHEMBL27260435 | 0.82 | HDAC3 (0.44) | KMT2ACNR2TDP1CYP1A2ALDH1A1 | |
| SCHEMBL13959564 | 0.81 | TDP1 (0.47) | CNR2TDP1CYP1A2ALDH1A1GLA | |
| SCHEMBL9420672 | 0.77 | CNR2 (0.40) | CNR2TDP1CYP1A2 | |
| SCHEMBL9420668 | 0.77 | CNR2 (0.40) | CNR2TDP1CYP1A2 | |
| SCHEMBL3070378 | 0.76 | CYP1A2 (0.47) | KMT2ACNR2TDP1CYP1A2ALDH1A1 | |
| SCHEMBL11988772 | 0.76 | CYP1A2 (0.47) | KMT2ACNR2TDP1CYP1A2ALDH1A1 | |
| SCHEMBL11584234 | 0.76 | TDP1 (0.50) | KMT2ACNR2TDP1CYP1A2ALDH1A1 | |
| SCHEMBL3070374 | 0.76 | CYP1A2 (0.47) | KMT2ACNR2TDP1CYP1A2ALDH1A1 |
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-0889879-A1 | BUTADIENE DERIVATIVES AND PROCESS FOR PREPARING THEREOF | TANABE SEIYAKU CO., LTD. (JP) | 1999-01-13 | — | — | EP | disclosed |
| WO-1997036864-A1 | BUTADIENE DERIVATIVES AND PROCESS FOR PREPARING THEREOF | TANABE SEIYAKU CO., LTD. (JP) | 1997-10-09 | — | — | WO | disclosed |