Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.36 |
| ▸ | TUBB | P07437 | 2/20 | 0.36 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.36 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.36 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.36 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.36 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.36 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.36 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.36 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.36 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.36 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.36 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 0.36 |
| ▸ | TUBB2B | Q9BVA1 | 2/20 | 0.36 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL470704 | 0.92 | PTGS2 (0.36) | PTGS2ALDH1A1CYP1A2CYP3A4LMNA | |
| SCHEMBL458358 | 0.89 | MAPT (0.43) | MAPTTUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL457816 | 0.80 | LMNA (0.40) | MAPTALDH1A1CYP1A2CYP3A4LMNA | |
| SCHEMBL458609 | 0.79 | KMT2A (0.50) | MAPTTUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL470696 | 0.73 | KMT2A (0.45) | MAPTTUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL458557 | 0.73 | ALDH1A1 (0.41) | MAPTALDH1A1CYP1A2CYP3A4LMNA | |
| SCHEMBL10073380 | 0.72 | POLB (0.39) | PTGS2ALDH1A1CYP1A2CYP3A4POLB | |
| SCHEMBL9441197 | 0.71 | MAPT (0.43) | MAPTALDH1A1CYP1A2LMNAHTT | |
| SCHEMBL457840 | 0.71 | CYP3A4 (0.42) | ALDH1A1CYP1A2CYP3A4LMNASMN1; SMN2 | |
| SCHEMBL458326 | 0.71 | CYP1A2 (0.39) | ALDH1A1CYP1A2CYP3A4LMNAHTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012031358-A1 | BIARYL DIPHOSPHINE LIGANDS, INTERMEDIATES OF THE SAME AND THEIR USE IN ASYMMETRIC CATALYSIS | KANATA CHEMICAL TECHNOLOGIES INC. (CA) | 2012-03-15 | — | — | WO | disclosed |