Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.36 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.35 |
| ▸ | ABL1 | P00519 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.34 |
| ▸ | BCR | P11274 | 1/20 | 0.34 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.34 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.34 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.34 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | GRIN2C | Q14957 | 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 | |
|---|---|---|---|---|
| SCHEMBL893113 | 0.80 | HPGD (0.44) | ALDH1A1CYP3A4HPGDHSD17B10KMT2A | |
| SCHEMBL3807690 | 0.80 | HPGD (0.44) | ALDH1A1HPGDHSD17B10ACHE | |
| SCHEMBL14008505 | 0.78 | HPGD (0.47) | ALDH1A1CYP3A4HPGDHSD17B10KMT2A | |
| SCHEMBL13067432 | 0.78 | ALDH1A1 (0.48) | ALDH1A1CYP3A4HPGDPTPN1TAAR1 | |
| SCHEMBL23638591 | 0.76 | HPGD (0.42) | ALDH1A1HPGDHSD17B10KMT2AMEN1 | |
| SCHEMBL5730733 | 0.76 | ALDH1A1 (0.46) | ALDH1A1CYP3A4HPGDPTPN1TAAR1 | |
| SCHEMBL16612059 | 0.76 | ALDH1A1 (0.46) | ALDH1A1CYP3A4HPGDHSD17B10PTPN1 | |
| SCHEMBL11930746 | 0.76 | HPGD (0.42) | ALDH1A1HPGDHSD17B10 | |
| SCHEMBL7952922 | 0.76 | ALDH1A1 (0.46) | ALDH1A1CYP3A4PTPN1 | |
| SCHEMBL10753734 | 0.76 | ALDH1A1 (0.46) | ALDH1A1CYP3A4HPGDPTPN1TAAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2066659-B1 | SUBSTITUTED SULFONAMIDE DERIVATIVES | GRUENENTHAL GMBH (DE) | 2013-08-28 | — | — | EP | disclosed |