Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IP6K1 | Q92551 | 9/20 | 0.51 |
| ▸ | IP6K3 | Q96PC2 | 7/20 | 0.51 |
| ▸ | IP6K2 | Q9UHH9 | 7/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6691319 | 0.88 | ALDH1A1 (0.55) | IP6K1IP6K3IP6K2ALDH1A1SMN1; SMN2 | |
| SCHEMBL2492556 | 0.86 | ALDH1A1 (0.62) | IP6K1IP6K3IP6K2ALDH1A1SMN1; SMN2 | |
| SCHEMBL31001160 | 0.81 | ALDH1A1 (0.46) | IP6K1IP6K3IP6K2ALDH1A1SMN1; SMN2 | |
| SCHEMBL10397089 | 0.79 | ALDH1A1 (0.56) | IP6K1IP6K3IP6K2ALDH1A1SMN1; SMN2 | |
| SCHEMBL1837436 | 0.79 | ALDH1A1 (0.47) | IP6K1IP6K3IP6K2ALDH1A1SMN1; SMN2 | |
| SCHEMBL8655645 | 0.79 | MEN1 (0.56) | IP6K1IP6K3IP6K2ALDH1A1SMN1; SMN2 | |
| SCHEMBL28602742 | 0.79 | ALDH1A1 (0.47) | IP6K1IP6K3IP6K2ALDH1A1SMN1; SMN2 | |
| SCHEMBL28526902 | 0.77 | CYP2A6 (0.42) | IP6K1IP6K3IP6K2ALDH1A1SMN1; SMN2 | |
| SCHEMBL10395873 | 0.75 | IP6K1 (0.47) | IP6K1IP6K3IP6K2ALDH1A1SMN1; SMN2 | |
| SCHEMBL10396913 | 0.75 | IP6K1 (0.47) | IP6K1IP6K3IP6K2ALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021110890-A1 | PYRIDINIUM DERIVATIVES AS HERBICIDES | SYNGENTA CROP PROTECTION AG (CH) | 2021-06-10 | — | — | WO | disclosed |
| WO-2021110890-A1 | PYRIDINIUM DERIVATIVES AS HERBICIDES | SYNGENTA CROP PROTECTION AG (CH) | 2021-06-10 | — | — | WO | disclosed |