Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UPP1 | Q16831 | 2/20 | 0.47 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.37 |
| ▸ | DPYD | Q12882 | 1/20 | 0.36 |
| ▸ | DAO | P14920 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | FASN | P49327 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.33 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.33 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.33 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7903836 | 0.98 | UPP1 (0.48) | UPP1TRPV4DPYDDAOKDM4E | |
| SCHEMBL5824339 | 0.80 | UPP1 (0.53) | UPP1DPYDKDM4ENPSR1HSD17B10 | |
| SCHEMBL5173757 | 0.69 | — | — | |
| SCHEMBL4742920 | 0.68 | DAO (0.36) | TRPV4DPYDDAOKDM4ENPSR1 | |
| SCHEMBL7900450 | 0.67 | MIF (0.39) | UPP1TRPV4KDM4EMAPTMEN1 | |
| SCHEMBL3393601 | 0.65 | DAO (0.51) | DAOKDM4EMAPTMEN1KMT2A | |
| SCHEMBL3391789 | 0.65 | DAO (0.51) | DAOKDM4ECYP1A2MAPTALOX15 | |
| SCHEMBL6651303 | 0.65 | TRPV4 (0.71) | TRPV4KHK | |
| SCHEMBL2783854 | 0.65 | TRPV4 (0.56) | TRPV4KDM4EARESR1ESR2 | |
| SCHEMBL1128865 | 0.65 | TRPV4 (0.46) | TRPV4ARESR1ESR2KHK |
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 2 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 | claimed |
| US-6197964-B1 | CHLORINATION USING BASIC CATALYST; DESALTING, HYDROLYSIS | BAYER AKTIENGESELLSCHAFT (DE) | 2001-03-06 | — | — | US | disclosed |