Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV4 | Q9HBA0 | 3/20 | 0.38 |
| ▸ | KHK | P50053 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | AR | P10275 | 3/20 | 0.33 |
| ▸ | VCAM1 | P19320 | 3/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7202604 | 0.86 | TRPV4 (0.38) | TRPV4KHKCYP11B2MAPK1ALDH1A1 | |
| SCHEMBL16122585 | 0.78 | ALDH1A1 (0.36) | TRPV4KHKCYP11B2MAPK1ALDH1A1 | |
| SCHEMBL1344881 | 0.78 | CYP3A4 (0.50) | TRPV4KHKMAPK1ALDH1A1AR | |
| SCHEMBL9844450 | 0.77 | TRPV4 (0.38) | TRPV4KHKCYP11B2ALDH1A1ESR1 | |
| SCHEMBL8727200 | 0.77 | TRPV4 (0.38) | TRPV4KHKCYP11B2MAPK1ALDH1A1 | |
| SCHEMBL7568676 | 0.77 | KHK (0.46) | TRPV4KHKCYP11B2ALDH1A1ESR1 | |
| Fluoride SCHEMBL9550843 | 0.76 | CYP3A4 (0.48) | TRPV4KHKMAPK1ALDH1A1AR | |
| SCHEMBL8045190 | 0.76 | ALDH1A1 (0.37) | TRPV4KHKCYP11B2MAPK1ALDH1A1 | |
| SCHEMBL7629039 | 0.76 | TRPV4 (0.45) | TRPV4KHKMAPK1ALDH1A1CYP3A4 | |
| SCHEMBL8664249 | 0.74 | TRPV4 (0.39) | TRPV4KHKCYP11B2MAPK1ALDH1A1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0635486-B1 | Process for the preparation of fluorobenzonitriles | CLARIANT GMBH (DE) | 1998-12-09 | — | — | EP | claimed |
| US-5466859-A | Process for preparing fluorobenzonitriles | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-11-14 | — | — | US | claimed |
| EP-0635486-A2 | Process for the preparation of fluorobenzonitriles | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-01-25 | — | — | EP | claimed |
| EP-0635486-B1 | Process for the preparation of fluorobenzonitriles | CLARIANT GMBH (DE) | 1998-12-09 | — | — | EP | disclosed |
| US-5466859-A | Process for preparing fluorobenzonitriles | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-11-14 | — | — | US | disclosed |
| EP-0635486-A2 | Process for the preparation of fluorobenzonitriles | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-01-25 | — | — | EP | disclosed |