Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA4 | P22748 | 2/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 3/20 | 0.38 |
| ▸ | CES1 | P23141 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | KMO | O15229 | 1/20 | 0.36 |
| ▸ | TTR | P02766 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL364018 | 0.79 | CA1 (0.50) | CA1CA2CA4KEAP1NFE2L2 | |
| SCHEMBL6725463 | 0.79 | DPP4 (0.33) | CA1CA2CA4DPP4KEAP1 | |
| SCHEMBL28205230 | 0.77 | DPP4 (0.38) | CA1CA2CA4DPP4KEAP1 | |
| SCHEMBL8377346 | 0.77 | DPP4 (0.44) | CA1CA2CA4DPP4KEAP1 | |
| SCHEMBL2926338 | 0.76 | NOTUM (0.38) | DPP4KMO | |
| SCHEMBL26162974 | 0.76 | CYP3A4 (0.42) | CA1CA2CA4DPP4CES2 | |
| SCHEMBL5336692 | 0.76 | KEAP1 (0.44) | CA1CA2CA4KEAP1NFE2L2 | |
| SCHEMBL31041213 | 0.76 | KEAP1 (0.44) | CA1CA2CA4KEAP1NFE2L2 | |
| SCHEMBL6728940 | 0.75 | AKR1C2 (0.37) | DPP4KEAP1NFE2L2KMOALDH1A1 | |
| SCHEMBL5784974 | 0.75 | DPP4 (0.43) | DPP4KEAP1NFE2L2CES2CES1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1114812-B1 | PROCESSES FOR THE PREPARATION OF FLUORINATED BENZOIC ACIDS | OTSUKA PHARMA CO LTD (JP) | 2007-06-20 | — | — | EP | disclosed |
| US-6333431-B1 | ALKYLATING TETRAFLUOROBENZOIC ACID | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2001-12-25 | — | — | US | disclosed |
| EP-1114812-A1 | PROCESSES FOR THE PREPARATION OF FLUORINATED BENZOIC ACIDS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2001-07-11 | — | — | EP | disclosed |