Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | P4HB | P07237 | 1/20 | 0.42 |
| ▸ | PDIA4 | P13667 | 1/20 | 0.42 |
| ▸ | PDIA3 | P30101 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29865166 | 0.92 | LMNA (0.52) | KMT2APOLBTSHRLMNACYP2D6 | |
| SCHEMBL24804649 | 0.92 | LMNA (0.52) | KMT2APOLBTSHRLMNACYP2D6 | |
| SCHEMBL9332848 | 0.92 | LMNA (0.52) | KMT2APOLBTSHRLMNACYP2D6 | |
| SCHEMBL9332856 | 0.92 | LMNA (0.52) | KMT2APOLBTSHRLMNACYP2D6 | |
| SCHEMBL2058841 | 0.89 | CYP3A4 (0.52) | CYP3A4KMT2AMEN1TP53CYP2C9 | |
| SCHEMBL2058839 | 0.89 | CYP3A4 (0.52) | CYP3A4KMT2AMEN1TP53CYP2C9 | |
| SCHEMBL827827 | 0.87 | NT5E (0.47) | KMT2APOLBTSHRLMNACYP2D6 | |
| SCHEMBL827826 | 0.87 | NT5E (0.47) | KMT2APOLBTSHRLMNACYP2D6 | |
| SCHEMBL6553337 | 0.85 | CYP3A4 (0.41) | CYP3A4KMT2AMEN1TP53CYP2C9 | |
| SCHEMBL6553329 | 0.85 | CYP3A4 (0.41) | CYP3A4KMT2AMEN1TP53CYP2C9 |
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-6084081-A | Lewis X derivatives | DAIKIN INDUSTRIES, LTD. (JP) | 2000-07-04 | — | — | US | disclosed |
| EP-0930315-A1 | LEWIS X DERIVATIVES | DAIKIN INDUSTRIES, LTD. (JP) | 1999-07-21 | — | — | EP | disclosed |