Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 3/20 | 0.43 |
| ▸ | BACE1 | P56817 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.37 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 3/20 | 0.36 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL16807084 | 0.95 | BACE1 (0.41) | ALOX5BACE1ALDH1A1MAPTKDM4E | |
| SCHEMBL16807113 | 0.90 | CYP4A11 (0.41) | ALOX5BACE1EGFRGABRA1GABRB2 | |
| SCHEMBL16807101 | 0.90 | BACE1 (0.44) | ALOX5BACE1ALDH1A1MAPTKDM4E | |
| SCHEMBL16807110 | 0.90 | ALOX5 (0.51) | ALOX5BACE1ALDH1A1MAPTKDM4E | |
| SCHEMBL16807140 | 0.90 | TSHR (0.40) | ALOX5EGFRCYP4F2CYP4A11TSHR | |
| SCHEMBL16807104 | 0.89 | BCHE (0.43) | ALOX5BACE1EGFRCYP4F2CYP4A11 | |
| SCHEMBL16807119 | 0.88 | RARB (0.45) | ALOX5ALDH1A1MAPT | |
| SCHEMBL16807108 | 0.88 | BCHE (0.45) | ALOX5BACE1ALDH1A1MAPTCYP4F2 | |
| SCHEMBL15725316 | 0.87 | BACE1 (0.46) | ALOX5BACE1ALDH1A1MAPTKDM4E | |
| SCHEMBL15725328 | 0.87 | ALOX5 (0.46) | ALOX5BACE1ALDH1A1MAPTKDM4E |
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-20150166890-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2015-06-18 | — | — | US | disclosed |
| US-20150166890-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2015-06-18 | — | — | US | disclosed |