Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | RORC | P51449 | 2/20 | 0.45 |
| ▸ | CNR2 | P34972 | 3/20 | 0.43 |
| ▸ | CNR1 | P21554 | 2/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1622016 | 0.96 | ALDH1A1 (0.55) | ALDH1A1MAPTHSD17B10HPGDTSHR | |
| SCHEMBL1621629 | 0.94 | CNR2 (0.48) | ALDH1A1MAPTHSD17B10HPGDCYP1A2 | |
| SCHEMBL4012648 | 0.85 | CNR2 (0.51) | ALDH1A1MAPTHSD17B10HPGDTSHR | |
| SCHEMBL16358874 | 0.79 | ALDH1A1 (0.55) | ALDH1A1MAPTHSD17B10HPGDTSHR | |
| SCHEMBL1621732 | 0.78 | ALDH1A1 (0.61) | ALDH1A1MAPTHSD17B10HPGDTSHR | |
| SCHEMBL1621484 | 0.78 | SMN1; SMN2 (0.57) | HSD17B10CNR2CNR1MAPK1MEN1 | |
| SCHEMBL1621286 | 0.78 | CNR2 (0.51) | ALDH1A1CNR2CNR1MAPK1MEN1 | |
| SCHEMBL15219069 | 0.77 | ALDH1A1 (0.48) | ALDH1A1MAPTHSD17B10HPGDCYP1A2 | |
| SCHEMBL1621081 | 0.77 | GCK (0.57) | ALDH1A1MAPTCNR2CNR1MAPK1 | |
| SCHEMBL1621250 | 0.77 | ALDH1A1 (0.58) | ALDH1A1MAPTHSD17B10HPGDCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2074084-A1 | COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR | Boehringer Ingelheim International GmbH (DE) | 2009-07-01 | — | — | EP | disclosed |
| WO-2008039645-A1 | COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-04-03 | — | — | WO | disclosed |