Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 6/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7976645 | 0.76 | ALDH1A1 (0.52) | ALDH1A1TSHRGAAKDM4EMAPT | |
| SCHEMBL456759 | 0.71 | — | — | |
| SCHEMBL28000372 | 0.71 | KDM4E (0.32) | ALDH1A1KDM4EHPGD | |
| SCHEMBL325076 | 0.70 | ALDH1A1 (0.62) | ALDH1A1TSHRGAAKDM4EMAPT | |
| SCHEMBL694140 | 0.69 | ALDH1A1 (0.38) | ALDH1A1TSHRGAAMAPTHPGD | |
| SCHEMBL4272715 | 0.69 | — | — | |
| Iodide SCHEMBL8715119 | 0.68 | ALDH1A1 (0.59) | ALDH1A1TSHRGAAKDM4EMAPT | |
| Allylthiourea SCHEMBL21714589 | 0.67 | TSHR (0.82) | ALDH1A1TSHRGAAKDM4EMAPT | |
| SCHEMBL4272718 | 0.67 | ALDH1A1 (0.56) | ALDH1A1TSHRGAAMAPTLMNA | |
| Allylthiourea SCHEMBL11625173 | 0.67 | TSHR (0.82) | ALDH1A1TSHRGAAKDM4EMAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2001064644-A1 | DICHLOROPYRIDYL- AND DICHLOROISOTHIAZOLYL-THIOCARBOXAMIDES AND THEIR USE AS MICROBICIDES | NIHON BAYER AGROCHEM K.K. (JP) | 2001-09-07 | — | — | WO | disclosed |