Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 5/20 | 0.71 |
| ▸ | CES1 | P23141 | 5/20 | 0.71 |
| ▸ | BCHE | P06276 | 1/20 | 0.71 |
| ▸ | ALB | P02768 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | KAT6A | Q92794 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | ERCC5 | P28715 | 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 | |
|---|---|---|---|---|
| SCHEMBL31537534 | 1.00 | CES2 (0.71) | CES2CES1BCHEALBHPGD | |
| SCHEMBL3440833 | 0.83 | CES2 (0.74) | CES2CES1BCHEALBHPGD | |
| SCHEMBL3184940 | 0.83 | CES2 (1.00) | CES2CES1BCHEALBHPGD | |
| SCHEMBL365453 | 0.81 | CES2 (0.71) | CES2CES1BCHEALBHPGD | |
| SCHEMBL1386835 | 0.81 | CES2 (0.71) | CES2CES1BCHEALBHPGD | |
| SCHEMBL580352 | 0.80 | CES2 (0.62) | CES2CES1BCHEALBHPGD | |
| SCHEMBL5180748 | 0.80 | CES2 (0.68) | CES2CES1BCHEALBHPGD | |
| SCHEMBL10962294 | 0.79 | CES2 (0.56) | CES2CES1BCHEALBHPGD | |
| Fluoride SCHEMBL6441128 | 0.79 | CES2 (0.68) | CES2CES1BCHEALBHPGD | |
| SCHEMBL203112 | 0.79 | CES2 (0.68) | CES2CES1BCHEALBHPGD |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1233010-B1 | Method for production of organic fluorine compound | NIPPON CATALYTIC CHEM IND (JP) | 2005-06-15 | — | — | EP | disclosed |
| EP-0899256-B1 | Method for production of organic fluorine compound | NIPPON CATALYTIC CHEM IND (JP) | 2003-08-06 | — | — | EP | disclosed |
| EP-1233010-A1 | Method for production of organic fluorine compound | Nippon Shokubai Co., Ltd. (JP) | 2002-08-21 | — | — | EP | disclosed |
| US-6392084-B1 | FLUORINATION OF AN ORGANO(BROMINE OR CHLORIDE) COMPOUND IN BENZONITRILE SOLVENT | NIPPON SHOKUBAI CO., LTD. (JP) | 2002-05-21 | — | — | US | disclosed |
| EP-0899256-A2 | Method for production of organic fluorine compound | NIPPON SHOKUBAI CO., LTD. (JP) | 1999-03-03 | — | — | EP | disclosed |
| CN-1097423-A | Quinolone-and naphthyridonecarboxylic acid derivatives | BAYER AG (DE) | 1995-01-18 | — | — | CN | disclosed |
| US-5315043-A | Potassium, cesium, rubidium fluorides and hydrofluoric acid | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1994-05-24 | — | — | US | disclosed |
| EP-0270964-B1 | PROCESS FOR OBTAINING SUBSTITUTED FLUOROBENZENES | BAYER AG (DE) | 1992-07-08 | — | — | EP | disclosed |
| WO-1990012780-A1 | INTERMEDIATES FOR THE PRODUCTION OF 2,4,5-TRIFLUORBENZOYL FLUORIDE | MALLINCKRODT, INC. (US) | 1990-11-01 | — | — | WO | disclosed |
| US-4868347-A | SOLVENT EXTRACTION | BAYER AKTIENGESELLSCHAFT (DE) | 1989-09-19 | — | — | US | disclosed |
| US-4847442-A | Process for the preparation of difluorobenzenes | ALLIED-SIGNAL INC. (US) | 1989-07-11 | — | — | US | disclosed |