Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | PLOD2 | O00469 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | HTR2C | P28335 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL3847336 | 0.98 | NPC1 (0.42) | NPC1RAB9APTPN1TSHRHTT | |
| SCHEMBL6936037 | 0.84 | GSK3B (0.44) | NPC1RAB9ATSHRHTTSMN1; SMN2 | |
| SCHEMBL6935144 | 0.84 | GSK3B (0.44) | RAB9AHTTSMN1; SMN2ALDH1A1KMT2A | |
| Bromide SCHEMBL4114709 | 0.83 | RAB9A (0.46) | NPC1RAB9ATSHRHTTSMN1; SMN2 | |
| Bromide SCHEMBL2947798 | 0.83 | RAB9A (0.46) | RAB9AHTTSMN1; SMN2ALDH1A1KMT2A | |
| Bromide SCHEMBL122634 | 0.83 | ALDH1A1 (0.43) | NPC1RAB9APTPN1SMN1; SMN2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL4019649 | 0.83 | ALDH1A1 (0.43) | RAB9APTPN1SMN1; SMN2ALDH1A1KDM4E | |
| Bromide SCHEMBL7402289 | 0.83 | ALDH1A1 (0.43) | NPC1RAB9APTPN1SMN1; SMN2ALDH1A1 | |
| SCHEMBL8390047 | 0.81 | ALDH1A1 (0.52) | NPC1RAB9AHTTALDH1A1KDM4E | |
| SCHEMBL8387913 | 0.81 | CES2 (0.45) | RAB9AHTR2AHTR2CKCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0808163-B1 | USE OF THIAZOLIUM COMPOUNDS FOR PREVENTING AND REVERSING THE FORMATION OF ADVANCED GLYCOSYLATION ENDPRODUCTS | ALTEON INC (US) | 2003-07-23 | — | — | EP | claimed |