Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 10/20 | 0.62 |
| ▸ | RAB9A | P51151 | 10/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.61 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.61 |
| ▸ | RELA | Q04206 | 3/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | STAT1 | P42224 | 1/20 | 0.61 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.57 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL9891526 | 0.81 | ADORA1 (0.69) | NPC1RAB9ASMN1; SMN2ALDH1A1NFKB1 | |
| SCHEMBL6227275 | 0.79 | MAPT (0.73) | NPC1RAB9ASMN1; SMN2ALDH1A1NFKB1 | |
| SCHEMBL1621757 | 0.78 | NPC1 (0.56) | NPC1RAB9ASMN1; SMN2ALDH1A1NFKB1 | |
| SCHEMBL10695859 | 0.78 | MAPT (0.75) | NPC1RAB9ASMN1; SMN2ALDH1A1NFKB1 | |
| SCHEMBL27622427 | 0.77 | MAPT (0.77) | NPC1RAB9ASMN1; SMN2ALDH1A1NFKB1 | |
| SCHEMBL20369717 | 0.77 | MAPT (0.77) | NPC1RAB9ASMN1; SMN2ALDH1A1NFKB1 | |
| SCHEMBL6229810 | 0.77 | NPC1 (1.00) | NPC1RAB9ASMN1; SMN2ALDH1A1NFKB1 | |
| SCHEMBL20015956 | 0.77 | DYRK1A (0.62) | NPC1RAB9ASMN1; SMN2ALDH1A1NFKB1 | |
| SCHEMBL29470113 | 0.76 | ADORA1 (0.52) | NPC1RAB9ASMN1; SMN2ALDH1A1NFKB1 | |
| SCHEMBL31041 | 0.76 | NPC1 (0.93) | NPC1RAB9ASMN1; SMN2ALDH1A1NFKB1 |
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-2074084-B1 | COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR | BOEHRINGER INGELHEIM INT (DE) | 2013-08-28 | — | — | EP | disclosed |