Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.34 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.34 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.34 |
| ▸ | ACACB | O00763 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 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 | |
|---|---|---|---|---|
| SCHEMBL20098173 | 0.82 | ESR1 (0.40) | DHFRGRIN2BCACNA1IGRIN1 | |
| SCHEMBL21024918 | 0.75 | ESR1 (0.44) | CACNA1I | |
| SCHEMBL21503707 | 0.74 | CASP3 (0.40) | CACNA1I | |
| SCHEMBL21479416 | 0.74 | CASP3 (0.40) | CACNA1I | |
| SCHEMBL21755121 | 0.72 | CASP3 (0.40) | CACNA1I | |
| SCHEMBL27334976 | 0.69 | CHRNB4 (0.37) | — | |
| SCHEMBL19464658 | 0.67 | CACNA1I (0.43) | CACNA1I | |
| SCHEMBL6202512 | 0.67 | SLC6A4 (0.41) | — | |
| SCHEMBL22087907 | 0.67 | CASP3 (0.40) | CACNA1I | |
| SCHEMBL12190561 | 0.66 | CACNA1I (0.43) | CACNA1I |
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 |
|---|---|---|---|---|---|---|---|
| CN-1045439-C | New herbicides | RHONE POULENC AGRICULTURE (GB) | 1999-10-06 | — | — | CN | claimed |
| CN-1085219-A | New herbicides | RHONE POULENC AGRICULTURE (GB) | 1994-04-13 | — | — | CN | claimed |