Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CETP | P11597 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7521941 | 1.00 | ALDH1A1 (0.38) | ALDH1A1CETPPKMTSHRLMNA | |
| SCHEMBL7532389 | 0.95 | ALDH1A1 (0.38) | ALDH1A1CETPPKMTSHRLMNA | |
| SCHEMBL7532391 | 0.95 | ALDH1A1 (0.38) | ALDH1A1CETPPKMTSHRLMNA | |
| SCHEMBL7530275 | 0.86 | CETP (0.40) | ALDH1A1CETPPKMTSHR | |
| SCHEMBL7530274 | 0.86 | CETP (0.40) | ALDH1A1CETPPKMTSHR | |
| SCHEMBL23489753 | 0.81 | GPR84 (0.41) | CETPPKMLMNACYP3A4HTT | |
| SCHEMBL8535016 | 0.81 | GPR84 (0.41) | CETPPKMLMNACYP3A4HTT | |
| SCHEMBL5804470 | 0.81 | GPR84 (0.41) | CETPPKMLMNACYP3A4HTT | |
| SCHEMBL9173507 | 0.79 | GPR84 (0.45) | CETPLMNACYP3A4HTT | |
| SCHEMBL1350818 | 0.79 | GPR84 (0.45) | CETPLMNACYP3A4HTT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0842915-B1 | Optically active alcohol and process for the production thereof | MITSUBISHI GAS CHEMICAL CO (JP) | 2002-03-27 | — | — | EP | disclosed |
| EP-0853076-B1 | Liquid crystal compound | MITSUBISHI GAS CHEMICAL CO (JP) | 2001-09-12 | — | — | EP | disclosed |
| US-6002042-A | Liquid crystal compound | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1999-12-14 | — | — | US | disclosed |
| EP-0853076-A1 | Liquid crystal compound | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1998-07-15 | — | — | EP | disclosed |
| EP-0842915-A2 | Optically active alcohol and process for the production thereof | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1998-05-20 | — | — | EP | disclosed |