Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MC4R | P32245 | 1/20 | 0.35 |
| ▸ | SCN4A | P35499 | 1/20 | 0.35 |
| ▸ | MC3R | P41968 | 1/20 | 0.35 |
| ▸ | HTR3A | P46098 | 1/20 | 0.35 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 4/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL177796 | 0.79 | — | — | |
| SCHEMBL31602039 | 0.79 | TDP1 (0.39) | ALDH1A1MAPTLMNAMAPK1CYP3A4 | |
| SCHEMBL14331808 | 0.78 | LDHA (0.38) | ALDH1A1MAPTLMNAMAPK1CYP3A4 | |
| Hydrochloric Acid SCHEMBL3453649 | 0.77 | CHRM2 (0.38) | ALDH1A1MAPTLMNAMAPK1CYP3A4 | |
| SCHEMBL4449358 | 0.75 | MAPT (0.32) | ALDH1A1MAPTLMNACYP3A4HPGD | |
| SCHEMBL1427782 | 0.75 | GABRR1 (0.35) | ALDH1A1MAPTLMNAMAPK1CYP3A4 | |
| SCHEMBL13685451 | 0.74 | TDP1 (0.33) | LMNABLMKDM4ETSHRCHRM2 | |
| SCHEMBL18902827 | 0.74 | CHRM2 (0.39) | ALDH1A1MAPTLMNAMAPK1CYP3A4 | |
| SCHEMBL6656901 | 0.74 | TDP1 (0.50) | ALDH1A1MAPTLMNAMAPK1CYP3A4 | |
| SCHEMBL5664190 | 0.73 | PAOX (0.37) | ALDH1A1LMNAMAPK1HPGDGAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0996606-B1 | CATALYSED FLUORINATION OF CARBONYL COMPOUNDS | F2 CHEMICALS LTD (GB) | 2002-01-16 | — | — | EP | disclosed |
| US-6300511-B1 | FLUORINATING CARBONYL COMPOUND BY REPLACEMENT OF ALPHA-HYDROGEN ATOM WITH FLUORINE COMPRISING REACTING COMPOUND WITH FLUORINATING AGENT IN PRESENCE OF CATALYTICALLY EFFECTIVE AMOUNT OF TRANSITION METAL-CONTAINING CATALYST | F2 CHEMICALS LIMITED (GB) | 2001-10-09 | — | — | US | disclosed |
| EP-0996606-A1 | CATALYSED FLUORINATION OF CARBONYL COMPOUNDS | F2 Chemicals Ltd. (GB) | 2000-05-03 | — | — | EP | disclosed |
| WO-1999003802-A1 | CATALYSED FLUORINATION OF CARBONYL COMPOUNDS | F2 CHEMICALS LIMITED (GB) | 1999-01-28 | — | — | WO | disclosed |