Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.40 |
| ▸ | RAB9A | P51151 | 5/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 5/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | RARB | P10826 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8066053 | 0.90 | RARB (0.41) | MAPTNPSR1RARBTSHRUSP2 | |
| SCHEMBL8066049 | 0.90 | RARB (0.41) | MAPTNPSR1RARBTSHRUSP2 | |
| SCHEMBL8076175 | 0.82 | NPC1 (0.44) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL9128180 | 0.80 | MAPT (0.38) | NPC1RAB9ASMN1; SMN2MAPTLMNA | |
| SCHEMBL8539467 | 0.78 | USP2 (0.36) | NPC1RAB9ASMN1; SMN2HSD17B10MAPT | |
| SCHEMBL9129539 | 0.77 | RARB (0.40) | MAPTNPSR1RARBTSHRUSP2 | |
| SCHEMBL8066037 | 0.76 | RAB9A (0.47) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL9237594 | 0.76 | RARB (0.53) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL9237597 | 0.76 | RARB (0.53) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL9239809 | 0.75 | RARB (0.58) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-5399291-A | Liquid crystal compounds having a fluoroether terminal portion | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1995-03-21 | — | — | US | disclosed |