Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 6/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.41 |
| ▸ | TUBB | P07437 | 2/20 | 0.41 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.41 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.41 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.41 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.41 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.41 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.41 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.41 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.41 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.41 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.41 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 0.41 |
| ▸ | TUBB2B | Q9BVA1 | 2/20 | 0.41 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 7/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8722883 | 0.91 | EGFR (0.51) | EGFRHDAC3TDP1TUBB4ATUBB | |
| SCHEMBL8722881 | 0.91 | EGFR (0.51) | EGFRHDAC3TDP1TUBB4ATUBB | |
| SCHEMBL5858046 | 0.91 | EGFR (0.51) | EGFRHDAC3TDP1TUBB4ATUBB | |
| SCHEMBL5858044 | 0.91 | EGFR (0.51) | EGFRHDAC3TDP1TUBB4ATUBB | |
| SCHEMBL5175602 | 0.88 | GLA (0.46) | EGFRHDAC3TDP1HDAC8HDAC6 | |
| Acrylic Acid SCHEMBL1985471 | 0.85 | EGFR (0.46) | EGFRHDAC3TDP1TUBB4ATUBB | |
| Acetic Acid SCHEMBL28444976 | 0.81 | EGFR (0.48) | EGFRHDAC3TDP1TUBB4ATUBB | |
| SCHEMBL27642615 | 0.78 | EGFR (0.47) | EGFRTDP1TUBB4ATUBBTUBA3C | |
| SCHEMBL6526872 | 0.78 | HDAC3 (0.43) | EGFRHDAC3TDP1HDAC8HDAC6 | |
| SCHEMBL20873608 | 0.78 | EGFR (0.45) | EGFRHDAC3TDP1TUBB4ATUBB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3043906-A1 | USE OF CERTAIN ORGANIC MATERIALS, CONTAINING ALKALI OR ALKALINE-EARTH METALS, FOR IMPLEMENTING ORGANIC CHEMICAL REACTIONS | Centre National De La Recherche Scientifique (FR) | 2016-07-20 | — | — | EP | disclosed |
| EP-1979435-B8 | REVERSIBLE THERMOCHROMIC COMPOSITIONS | BASF SE (DE) | 2012-02-15 | — | — | EP | disclosed |
| EP-1979435-B1 | REVERSIBLE THERMOCHROMIC COMPOSITIONS | BASF SE (DE) | 2011-05-25 | — | — | EP | disclosed |
| WO-2007085636-A1 | REVERSIBLE THERMOCHROMIC COMPOSITIONS | CIBA HOLDING INC. (CH) | 2007-08-02 | — | — | WO | disclosed |