Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | RORC | P51449 | 5/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | ALPL | P05186 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.36 |
| ▸ | DAO | P14920 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | RXRA | P19793 | 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 | |
|---|---|---|---|---|
| SCHEMBL16807079 | 0.95 | EGFR (0.42) | EGFRALDH1A1RORCNPC1LMNA | |
| SCHEMBL16807095 | 0.90 | BACE1 (0.40) | ALOX5ALDH1A1RORCMAPTHSD17B1 | |
| SCHEMBL16807145 | 0.89 | EGFR (0.41) | EGFRALDH1A1NPC1LMNAMAPT | |
| SCHEMBL16807112 | 0.88 | ALOX5 (0.49) | ALOX5RORCNPC1MAPTRAB9A | |
| SCHEMBL16807111 | 0.86 | ALOX5 (0.43) | EGFRALOX5ALDH1A1RORCNPC1 | |
| SCHEMBL15725315 | 0.86 | BACE1 (0.41) | ALDH1A1RORCMAPTS1PR1S1PR5 | |
| SCHEMBL16807123 | 0.85 | RARB (0.46) | ALOX5ALDH1A1MAPT | |
| SCHEMBL16807120 | 0.84 | RARB (0.51) | EGFRALDH1A1LMNAMAPT | |
| SCHEMBL16807087 | 0.84 | BACE1 (0.41) | ALDH1A1RORCNPC1MAPTRAB9A | |
| SCHEMBL15725352 | 0.84 | ALOX5 (0.44) | ALOX5NPC1MAPTRAB9AL3MBTL1 |
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 |