Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | KIF11 | P52732 | 6/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.48 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.48 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.48 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.48 |
| ▸ | MGLL | Q99685 | 1/20 | 0.48 |
| ▸ | GSK3B | P49841 | 2/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.42 |
| ▸ | HTR3B | O95264 | 1/20 | 0.42 |
| ▸ | PLAU | P00749 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.42 |
| ▸ | HTR3C | Q8WXA8 | 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 | |
|---|---|---|---|---|
| SCHEMBL63468 | 0.86 | ALDH1A1 (0.67) | ALDH1A1TSHRKIF11CES2CES1 | |
| SCHEMBL13205250 | 0.80 | ALDH1A1 (0.53) | ALDH1A1TSHRKIF11CES2CES1 | |
| SCHEMBL677817 | 0.80 | ALDH1A1 (0.53) | ALDH1A1TSHRKIF11CES2CES1 | |
| Iodide SCHEMBL29093539 | 0.79 | ALDH1A1 (0.59) | ALDH1A1TSHRKIF11CES2CES1 | |
| Bromide SCHEMBL29093544 | 0.79 | ALDH1A1 (0.59) | ALDH1A1TSHRKIF11CES2CES1 | |
| SCHEMBL8909 | 0.78 | TRPV1 (0.50) | ALDH1A1TSHRKIF11CES2CES1 | |
| SCHEMBL197238 | 0.76 | KIF11 (0.78) | ALDH1A1TSHRKIF11CES2CES1 | |
| SCHEMBL16626100 | 0.76 | ALDH1A1 (0.56) | ALDH1A1TSHRKIF11CES2CES1 | |
| SCHEMBL13410633 | 0.76 | KIF11 (0.78) | ALDH1A1TSHRKIF11CES2CES1 | |
| SCHEMBL29914837 | 0.76 | KIF11 (0.78) | ALDH1A1TSHRKIF11CES2CES1 |
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-4351975-A | Process for preparing chlorinated compounds | CIBA-GEIGY AG (CH) | 1982-09-28 | — | — | US | disclosed |
| EP-0036840-A2 | Process for the production of chlorinated compounds | CIBA-GEIGY AG (CH) | 1981-09-30 | — | — | EP | disclosed |