Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 5/20 | 0.40 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5505271 | 0.77 | CA12 (0.48) | KMT2ATDP1HCRTR2CA12CA9 | |
| SCHEMBL3555916 | 0.77 | TDP1 (0.58) | KMT2ATDP1CA12CA9ESR1 | |
| SCHEMBL3693999 | 0.76 | TSHR (0.49) | KMT2ATDP1HCRTR2CA12CA9 | |
| SCHEMBL7972381 | 0.76 | HTR2A (0.49) | KMT2ATDP1HCRTR2HTR2AHTR2C | |
| SCHEMBL5507153 | 0.76 | CA12 (0.47) | KMT2ATDP1HCRTR2CA12CA9 | |
| SCHEMBL9001236 | 0.74 | ALDH1A1 (0.54) | KMT2ATDP1HCRTR2TSHRMAPK1 | |
| SCHEMBL2583710 | 0.73 | TSHR (0.57) | KMT2ATDP1HCRTR2ESR1TSHR | |
| SCHEMBL9307793 | 0.73 | ALDH1A1 (0.47) | KMT2ATDP1HCRTR2CA12CA9 | |
| SCHEMBL4566032 | 0.73 | HCRTR2 (0.48) | KMT2ATDP1HCRTR2HTR2AHTR2C | |
| SCHEMBL28278188 | 0.72 | TDP1 (0.41) | KMT2ATDP1HCRTR2HTR2AHTR2C |
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 |
|---|---|---|---|---|---|---|---|
| US-5502028-A | Herbicidal pyrimidinyl or triazinyl haloacetic acid derivatives | SCHERING AGROCHEMICALS LIMITED (GB) | 1996-03-26 | — | — | US | disclosed |
| EP-0575404-A1 | HERBICIDES | AgrEvo UK Limited (GB) | 1993-12-29 | — | — | EP | disclosed |
| WO-1992016511-A1 | HERBICIDES | SCHERING AGROCHEMICALS LIMITED (GB) | 1992-10-01 | — | — | WO | disclosed |