Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Dimethyl Acetylphosphonate SCHEMBL2459022 | 0.76 | — | — | |
| SCHEMBL11681819 | 0.76 | — | — | |
| SCHEMBL5683227 | 0.73 | — | — | |
| SCHEMBL11680447 | 0.73 | — | — | |
| SCHEMBL842263 | 0.73 | ALDH1A1 (0.37) | ALDH1A1L3MBTL1TSHR | |
| SCHEMBL11343993 | 0.71 | ALDH1A1 (0.33) | ALDH1A1LMNACYP3A4ALOX15TSHR | |
| SCHEMBL14710274 | 0.71 | CA4 (0.35) | ALDH1A1L3MBTL1TSHR | |
| SCHEMBL24052029 | 0.69 | MMP2 (0.50) | ALDH1A1L3MBTL1 | |
| SCHEMBL2993052 | 0.69 | TDP1 (0.33) | ALDH1A1LMNATSHR | |
| SCHEMBL2990206 | 0.69 | CA12 (0.33) | ALDH1A1LMNACYP2C19 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6147245-A | Preparation and use of α-Keto Bisphosphonates | UNIVERSITY OF SOUTHERN CALIFORNIA UNIVERSITY PARK (US) | 2000-11-14 | — | — | US | claimed |
| EP-1097160-A4 | PREPARATION AND USE OF ALPHA-KETO BISPHOSPHONATES | UNIV SOUTHERN CALIFORNIA (US) | 2002-06-12 | — | — | EP | disclosed |
| EP-1097160-A1 | PREPARATION AND USE OF ALPHA-KETO BISPHOSPHONATES | UNIVERSITY OF SOUTHERN CALIFORNIA (US) | 2001-05-09 | — | — | EP | disclosed |
| US-6147245-A | Preparation and use of α-Keto Bisphosphonates | UNIVERSITY OF SOUTHERN CALIFORNIA UNIVERSITY PARK (US) | 2000-11-14 | — | — | US | disclosed |
| WO-2000002889-A1 | PREPARATION AND USE OF α-KETO BISPHOSPHONATES | THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) | 2000-01-20 | — | — | WO | disclosed |