Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 4/20 | 0.48 |
| ▸ | CA2 | P00918 | 4/20 | 0.48 |
| ▸ | CA12 | O43570 | 3/20 | 0.48 |
| ▸ | CA7 | P43166 | 3/20 | 0.48 |
| ▸ | CA9 | Q16790 | 3/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.48 |
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.48 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | USP2 | O75604 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6560050 | 0.86 | KMT2A (0.50) | MKNK2CYP3A4HPGDCA1CA2 | |
| SCHEMBL17779160 | 0.78 | CYP3A4 (0.74) | CYP3A4HPGDCA1CA2CA12 | |
| SCHEMBL12770779 | 0.78 | HPGD (0.48) | CYP3A4HPGDTDP1L3MBTL1KMT2A | |
| SCHEMBL13554532 | 0.77 | CYP3A4 (0.63) | CYP3A4HPGDCA1CA2CA12 | |
| SCHEMBL10364284 | 0.76 | HPGD (0.68) | CYP3A4HPGDCA1CA2CA12 | |
| SCHEMBL2829414 | 0.74 | HSD17B2 (0.55) | CYP3A4HPGDCA1CA2CA12 | |
| Ethylparaben SCHEMBL7073652 | 0.74 | CA12 (0.85) | CYP3A4HPGDCA1CA2CA12 | |
| SCHEMBL4841792 | 0.74 | NPC1 (0.62) | MKNK2CYP3A4HPGDCA1CA2 | |
| SCHEMBL4106403 | 0.73 | CYP3A4 (0.71) | CYP3A4HPGDHSD17B2TDP1L3MBTL1 | |
| SCHEMBL6507929 | 0.73 | SMN1; SMN2 (0.53) | MKNK2CYP3A4HPGDCA1CA2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1404372-A1 | PHARMACEUTICAL FORMULATIONS AND LIGANDS FOR USE THEREIN; MIMETICS FOR UEA-1 | Sarlan, Ltd. (BM) | 2004-04-07 | — | — | EP | disclosed |
| WO-2003004062-A9 | PHARMACEUTICAL FORMULATIONS AND LIGANDS FOR USE THEREIN; MIMETICS FOR UEA-1 | SARLAN LTD | 2003-04-10 | — | — | WO | disclosed |
| WO-2003004062-A1 | PHARMACEUTICAL FORMULATIONS AND LIGANDS FOR USE THEREIN; MIMETICS FOR UEA-1 | SARLAN, LTD. (BM) | 2003-01-16 | — | — | WO | disclosed |