Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BLM | P54132 | 2/20 | 0.51 |
| ▸ | GHSR | Q92847 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | APEX1 | P27695 | 2/20 | 0.36 |
| ▸ | RECQL | P46063 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4269487 | 0.76 | ALDH1A1 (0.44) | ALDH1A1KMT2AMEN1CA2CA9 | |
| SCHEMBL4344157 | 0.75 | ALDH1A1 (0.43) | GHSRALDH1A1KMT2AMEN1CA2 | |
| SCHEMBL9386400 | 0.75 | BLM (0.63) | BLMALDH1A1ESR1KMT2AMEN1 | |
| SCHEMBL9386398 | 0.75 | BLM (0.63) | BLMALDH1A1ESR1KMT2AMEN1 | |
| SCHEMBL503526 | 0.74 | BLM (0.67) | BLMALDH1A1ELANEESR1KMT2A | |
| SCHEMBL540243 | 0.74 | BLM (0.67) | BLMALDH1A1ELANEESR1KMT2A | |
| SCHEMBL503525 | 0.74 | BLM (0.67) | BLMALDH1A1ELANEESR1KMT2A | |
| SCHEMBL9982800 | 0.74 | ALDH1A1 (0.49) | ALDH1A1ELANEESR1KMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL540244 | 0.73 | BLM (0.65) | BLMALDH1A1ELANEESR1KMT2A | |
| SCHEMBL12659178 | 0.73 | BLM (0.47) | BLMGHSRALDH1A1KMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005057589-A2 | MULTI-PURPOSE AUTOMATED RADIOTRACER SYNTHESIZER | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2005-06-23 | — | — | WO | disclosed |