Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 10/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.53 |
| ▸ | MEN1 | O00255 | 8/20 | 0.53 |
| ▸ | MAPT | P10636 | 6/20 | 0.53 |
| ▸ | GAA | P10253 | 5/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | XBP1 | P17861 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | SMO | Q99835 | 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 | |
|---|---|---|---|---|
| SCHEMBL6812705 | 0.80 | ALDH1A1 (0.60) | KMT2AALDH1A1MEN1MAPTGAA | |
| SCHEMBL8533988 | 0.79 | NR3C2 (0.40) | KMT2AALDH1A1MEN1MAPTGAA | |
| SCHEMBL6813184 | 0.78 | ALDH1A1 (0.57) | KMT2AALDH1A1MEN1MAPTGAA | |
| SCHEMBL6812366 | 0.77 | KMT2A (0.58) | KMT2AALDH1A1MEN1MAPTGAA | |
| SCHEMBL6813779 | 0.74 | MEN1 (0.55) | KMT2AALDH1A1MEN1MAPTGAA | |
| SCHEMBL6809706 | 0.72 | HDAC8 (0.60) | KMT2AALDH1A1MEN1MAPTGAA | |
| SCHEMBL6812397 | 0.72 | ALDH1A1 (0.57) | KMT2AALDH1A1MEN1MAPTGAA | |
| SCHEMBL5450034 | 0.72 | GAA (0.76) | KMT2AALDH1A1MEN1MAPTGAA | |
| SCHEMBL6813268 | 0.71 | HDAC8 (0.56) | KMT2AALDH1A1MEN1MAPTGAA | |
| SCHEMBL6813288 | 0.71 | ALDH1A1 (0.65) | KMT2AALDH1A1MEN1MAPTGAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1042276-A1 | THIOUREA COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING OR PREVENTING INFLAMMATORY DISEASES AND ATHEROSCLEROSIS | WARNER-LAMBERT COMPANY LLC (US) | 2000-10-11 | — | — | EP | disclosed |
| WO-1999032433-A1 | THIOUREA AND BENZAMIDE COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING OR PREVENTING INFLAMMATORY DISEASES AND ATHEROSCLEROSIS | WARNER-LAMBERT COMPANY (US) | 1999-07-01 | — | — | WO | disclosed |