Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | ERN1 | O75460 | 2/20 | 0.33 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.33 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.33 |
| ▸ | PRKDC | P78527 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5166895 | 0.86 | CYP1A2 (0.31) | ERN1CYP1A2MAPTCYP2C9CYP2C19 | |
| SCHEMBL441131 | 0.81 | CA1 (0.44) | ALDH1A1ERN1CA12CA1CA2 | |
| SCHEMBL5167370 | 0.80 | LMNA (0.41) | ALDH1A1LMNACYP2C9CYP2C19 | |
| SCHEMBL5167544 | 0.79 | ALDH1A1 (0.34) | ALDH1A1ERN1PRKDCKDM4ETSHR | |
| SCHEMBL20561607 | 0.72 | ALDH1A1 (0.42) | ALDH1A1ERN1TUBB1PRKDCKDM4E | |
| SCHEMBL8684580 | 0.71 | CA1 (0.41) | ALDH1A1CA12CA1CA2CA7 | |
| SCHEMBL4746715 | 0.71 | ERN1 (0.35) | ALDH1A1ERN1CA12CA1CA2 | |
| SCHEMBL28273088 | 0.71 | CA1 (0.37) | ALDH1A1ERN1CA12CA1CA2 | |
| SCHEMBL364732 | 0.71 | ALDH1A1 (0.44) | ALDH1A1ERN1AKR1B1TUBB1PRKDC | |
| SCHEMBL20562164 | 0.70 | ERN1 (0.56) | ERN1CA12CA1CA2CA7 |
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-1182184-B1 | PROCESS FOR PRODUCING TETRAFLUORO BENZENECARBALDEHYDES AND TETRAFLUORO BENZENEMETHANOLS | SHOWA DENKO KK (JP) | 2007-04-18 | — | — | EP | claimed |
| EP-1182184-B1 | PROCESS FOR PRODUCING TETRAFLUORO BENZENECARBALDEHYDES AND TETRAFLUORO BENZENEMETHANOLS | SHOWA DENKO KK (JP) | 2007-04-18 | — | — | EP | disclosed |
| US-6624336-B1 | Acetalization of tetrafluorobenzonitriles using alcohols, in the presence of mineral acids and metal catalysts to form chemical intermediates for nontoxic insecticides | SHOWA DENKO K.K. (JP) | 2003-09-23 | — | — | US | disclosed |
| EP-1182184-A1 | PROCESS FOR PRODUCING TETRAFLUORO BENZENEMETHANOLS | Showa Denko K K (JP) | 2002-02-27 | — | — | EP | disclosed |