Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.38 |
| ▸ | TUBB1 | Q9H4B7 | 10/20 | 0.37 |
| ▸ | TUBB4A | P04350 | 4/20 | 0.34 |
| ▸ | TUBB | P07437 | 4/20 | 0.34 |
| ▸ | TUBA3C | P0DPH7 | 4/20 | 0.34 |
| ▸ | TUBA1B | P68363 | 4/20 | 0.34 |
| ▸ | TUBA4A | P68366 | 4/20 | 0.34 |
| ▸ | TUBB4B | P68371 | 4/20 | 0.34 |
| ▸ | TUBB3 | Q13509 | 4/20 | 0.34 |
| ▸ | TUBB2A | Q13885 | 4/20 | 0.34 |
| ▸ | TUBB8 | Q3ZCM7 | 4/20 | 0.34 |
| ▸ | TUBA3E | Q6PEY2 | 4/20 | 0.34 |
| ▸ | TUBA1A | Q71U36 | 4/20 | 0.34 |
| ▸ | TUBA1C | Q9BQE3 | 4/20 | 0.34 |
| ▸ | TUBB6 | Q9BUF5 | 4/20 | 0.34 |
| ▸ | TUBB2B | Q9BVA1 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15722958 | 0.84 | — | — | |
| SCHEMBL18219772 | 0.81 | KCNA3 (0.32) | NFE2L2 | |
| SCHEMBL18134248 | 0.81 | ALDH1A1 (0.46) | NFE2L2TUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL18088066 | 0.81 | ALDH1A1 (0.46) | NFE2L2TUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL13394231 | 0.81 | TUBB1 (0.35) | NFE2L2TUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL10302914 | 0.78 | NFE2L2 (0.46) | NFE2L2TUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL8988010 | 0.78 | CTSL (0.40) | — | |
| SCHEMBL8988009 | 0.78 | CTSL (0.40) | — | |
| SCHEMBL10302913 | 0.77 | TUBB1 (0.45) | NFE2L2TUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL17016783 | 0.77 | TUBB1 (0.34) | TUBB1KDM4EPTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9737854-B2 | Process for the purification of a liquid-crystal mixture | MERCK PATENT GMBH (DE) | 2017-08-22 | — | — | US | disclosed |
| US-20160325231-A1 | PROCESS FOR THE PURIFICATION OF A LIQUID-CRYSTAL MIXTURE | MERCK PATENT GMBH (DE) | 2016-11-10 | — | — | US | disclosed |