Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.63 |
| ▸ | RAB9A | P51151 | 7/20 | 0.62 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.62 |
| ▸ | HTR1A | P08908 | 1/20 | 0.59 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 6/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.58 |
| ▸ | HTT | P42858 | 3/20 | 0.58 |
| ▸ | MAPT | P10636 | 3/20 | 0.58 |
| ▸ | THRB | P10828 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL27034912 | 0.85 | TSHR (0.60) | NPC1RAB9AL3MBTL1TSHRMAPK1 | |
| SCHEMBL12092543 | 0.85 | HTT (0.61) | NPC1RAB9ATSHRHTTTHRB | |
| SCHEMBL27035015 | 0.83 | SMN1; SMN2 (0.61) | NPC1RAB9AL3MBTL1TSHRHTT | |
| SCHEMBL7947228 | 0.83 | HTR1A (0.73) | NPC1RAB9ANOTUMHTR1AHRH3 | |
| SCHEMBL27035210 | 0.83 | NPC1 (0.64) | NPC1RAB9ATSHRMAPK1HTT | |
| SCHEMBL8512061 | 0.83 | NOTUM (0.47) | NPC1RAB9ANOTUMCYP1A2TSHR | |
| SCHEMBL8428106 | 0.82 | MAPT (0.54) | NPC1RAB9AL3MBTL1TSHRHTT | |
| SCHEMBL7945605 | 0.82 | NPC1 (0.46) | NPC1RAB9ANOTUMHTR1AHRH3 | |
| SCHEMBL27035148 | 0.81 | ALDH1A1 (0.65) | NPC1RAB9AL3MBTL1TSHRMAPK1 | |
| SCHEMBL7961634 | 0.81 | HTR1A (0.65) | NPC1RAB9ANOTUMHTR1AHRH3 |
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-6277872-B1 | ANTIISCHEMIC AGENTS; BRAIN DISORDERS | BOEHRINGER INGELHEIM KG (DE) | 2001-08-21 | — | — | US | disclosed |