Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MIF | P14174 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | GPR35 | Q9HC97 | 5/20 | 0.37 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.37 |
| ▸ | ESR1 | P03372 | 4/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.33 |
| ▸ | KHK | P50053 | 1/20 | 0.33 |
| ▸ | UPP1 | Q16831 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.30 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL8016613 | 0.98 | MIF (0.40) | MIFCA9GPR35TRPV4ESR1 | |
| SCHEMBL5154098 | 0.69 | — | — | |
| SCHEMBL7906397 | 0.67 | UPP1 (0.47) | TRPV4ESR1ESR2KHKUPP1 | |
| SCHEMBL12814043 | 0.65 | GPR35 (0.68) | MIFCA9GPR35ESR1ESR2 | |
| SCHEMBL6651303 | 0.65 | TRPV4 (0.71) | TRPV4KHKALDH1A1 | |
| SCHEMBL2783854 | 0.65 | TRPV4 (0.56) | TRPV4ESR1ESR2KHKKDM4E | |
| SCHEMBL1128865 | 0.65 | TRPV4 (0.46) | TRPV4ESR1ESR2KHK | |
| SCHEMBL7903836 | 0.64 | UPP1 (0.48) | TRPV4ESR1ESR2KHKUPP1 | |
| Sulfuric Acid SCHEMBL28577787 | 0.63 | TRPV4 (0.45) | TRPV4ESR1ESR2KHKMEN1 | |
| Sulfuric Acid SCHEMBL28577786 | 0.63 | TRPV4 (0.45) | TRPV4ESR1ESR2KHKMEN1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6197964-B1 | CHLORINATION USING BASIC CATALYST; DESALTING, HYDROLYSIS | BAYER AKTIENGESELLSCHAFT (DE) | 2001-03-06 | — | — | US | disclosed |
| CN-1259123-A | Method for the production of 2,6-dichloro-5-fluoronicotinonitrile and the chemical compound 3-cyano-2-hydroxy-5-fluoropyride-6-one-monosodium salt and its tautomers | BAYER AG (DE) | 2000-07-05 | — | — | CN | disclosed |
| CN-1259123-A | Method for the production of 2,6-dichloro-5-fluoronicotinonitrile and the chemical compound 3-cyano-2-hydroxy-5-fluoropyride-6-one-monosodium salt and its tautomers | BAYER AG (DE) | 2000-07-05 | — | — | CN | disclosed |
| EP-0973745-A1 | METHOD FOR THE PRODUCTION OF 2,6-DICHLORO-5-FLUORONICOTINONITRILE AND THE CHEMICAL COMPOUND 3-CYANO-2-HYDROXY-5-FLUOROPYRIDE-6-ONE-MONOSODIUM SALT AND ITS TAUTOMERS | BAYER AG (DE) | 2000-01-26 | — | — | EP | disclosed |
| WO-1998043958-A1 | METHOD FOR THE PRODUCTION OF 2,6-DICHLORO-5-FLUORONICOTINONITRILE AND THE CHEMICAL COMPOUND 3-CYANO-2-HYDROXY-5-FLUOROPYRIDE-6-ONE-MONOSODIUM SALT AND ITS TAUTOMERS | BAYER AKTIENGESELLSCHAFT (DE) | 1998-10-08 | — | — | WO | disclosed |