Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.61 |
| ▸ | ELANE | P08246 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 4/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 5/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Benzophenone SCHEMBL9809029 | 0.98 | ALDH1A1 (0.64) | ALDH1A1ELANEHPGDL3MBTL1ATM | |
| Benzophenone SCHEMBL1147390 | 0.98 | ALDH1A1 (0.64) | ALDH1A1ELANEHPGDL3MBTL1ATM | |
| Benzophenone SCHEMBL1147611 | 0.98 | ALDH1A1 (0.64) | ALDH1A1ELANEHPGDL3MBTL1ATM | |
| Benzophenone SCHEMBL28105799 | 0.90 | RAB9A (0.60) | ALDH1A1ELANEHPGDL3MBTL1ATM | |
| Benzoic Acid SCHEMBL931656 | 0.84 | TSHR (0.64) | ALDH1A1SRD5A2LMNANPC1MEN1 | |
| Benzil SCHEMBL2684477 | 0.84 | CES2 (0.64) | ALDH1A1HPGDRAB9ALMNACES2 | |
| Benzoic Acid SCHEMBL9460609 | 0.84 | TSHR (0.64) | ALDH1A1SRD5A2LMNANPC1MEN1 | |
| Benzophenone SCHEMBL8089683 | 0.84 | ALDH1A1 (0.78) | ALDH1A1ELANEHPGDL3MBTL1ATM | |
| SCHEMBL6748919 | 0.83 | ALDH1A1 (0.59) | ALDH1A1ELANEHPGDL3MBTL1ATM | |
| Ether SCHEMBL9731245 | 0.83 | AKR1C3 (0.50) | ALDH1A1ELANEHPGDL3MBTL1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-6231783-B1 | SOLVENT SYSTEMS HAVING IMPROVED PHYSICAL PROPERTIES TO MINIMIZE ENTRY INTO THE ENVIRONMENT AND TO FACILITATE SEPARATIONS AND CLEANING OPERATIONS TO MINIMIZE POLLUTION | MASSACHUSETTS INSTITUTE OF TECHNOLOGY | 2001-05-15 | — | — | US | disclosed |
| WO-1997018179-A1 | REPLACEMENT SOLVENTS FOR USE IN CHEMICAL SYNTHESIS | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 1997-05-22 | — | — | WO | disclosed |