Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4661323 | 1.00 | ALDH1A1 (0.41) | ALDH1A1ALOX15TSHRALOX12HSD17B10 | |
| SCHEMBL4662765 | 0.86 | CDK4 (0.38) | ALDH1A1HTTKDM4ELIMK2 | |
| SCHEMBL4661449 | 0.85 | CDK4 (0.38) | ALDH1A1CYP3A4MAPK1HIF1AHTT | |
| SCHEMBL4661583 | 0.85 | CDK4 (0.38) | ALDH1A1CYP3A4MAPK1HIF1AHTT | |
| SCHEMBL4661488 | 0.82 | HTT (0.40) | ALDH1A1MAPK1HTTLMNAMEN1 | |
| SCHEMBL4661399 | 0.81 | PYCR1 (0.42) | ALDH1A1TSHRMAPK1HTTLMNA | |
| SCHEMBL4661305 | 0.81 | PYCR1 (0.42) | ALDH1A1TSHRMAPK1HTTLMNA | |
| SCHEMBL4661434 | 0.80 | CDK4 (0.40) | MAPK1TDP1RECQLATMMEN1 | |
| SCHEMBL4664189 | 0.80 | TYMS (0.46) | ALDH1A1TSHRHTTL3MBTL1MAPT | |
| SCHEMBL4661324 | 0.75 | PTPN1 (0.39) | ALDH1A1ALOX15TSHRALOX12HSD17B10 |
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-2007707-A1 | COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR | Boehringer Ingelheim International GmbH (DE) | 2008-12-31 | — | — | EP | disclosed |
| WO-2007118041-A1 | COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2007-10-18 | — | — | WO | disclosed |