Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | NAAA | Q02083 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7686193 | 0.88 | ALDH1A1 (0.40) | CYP1A2ALDH1A1LMNAMAPTTDP1 | |
| SCHEMBL3703287 | 0.79 | KMT2A (0.42) | ALDH1A1LMNATDP1KMT2ARAB9A | |
| SCHEMBL17785167 | 0.77 | ALDH1A1 (0.42) | ALDH1A1LMNAALOX15KMT2ARAB9A | |
| SCHEMBL21798099 | 0.75 | MGAM (0.41) | CYP1A2ALDH1A1LMNAKMT2ARAB9A | |
| SCHEMBL24066826 | 0.74 | EPHX2 (0.51) | NAAAEPHX2 | |
| SCHEMBL9109410 | 0.74 | CYP1A2 (0.59) | CYP1A2ALDH1A1LMNATDP1ALOX15 | |
| SCHEMBL11616108 | 0.74 | CYP1A2 (0.59) | CYP1A2ALDH1A1TDP1ALOX15SMYD3 | |
| SCHEMBL7683870 | 0.72 | CYP1A2 (0.48) | CYP1A2ALDH1A1LMNAMAPTTDP1 | |
| SCHEMBL24740428 | 0.72 | TDP1 (0.55) | CYP1A2ALDH1A1LMNATDP1ALOX15 | |
| SCHEMBL5827221 | 0.72 | CYP1A2 (0.48) | CYP1A2ALDH1A1LMNAMAPTTDP1 |
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-2342199-A2 | COMPOUNDS WHICH SELECTIVELY MODULATE THE CB2 RECEPTOR | Boehringer Ingelheim International GmbH (DE) | 2011-07-13 | — | — | EP | disclosed |
| WO-2010036631-A2 | COMPOUNDS WHICH SELECTIVELY MODULATE THE CB2 RECEPTOR | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-04-01 | — | — | WO | disclosed |