Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 5/20 | 0.59 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.59 |
| ▸ | PARP1 | P09874 | 1/20 | 0.56 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.56 |
| ▸ | ATM | Q13315 | 2/20 | 0.54 |
| ▸ | CTSG | P08311 | 1/20 | 0.54 |
| ▸ | CMA1 | P23946 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | MDM4 | O15151 | 1/20 | 0.53 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL9440111 | 1.00 | HDAC1 (0.59) | HDAC1HDAC6PARP1PARP3ATM | |
| SCHEMBL4145476 | 0.92 | HDAC1 (0.63) | HDAC1HDAC6PARP1PARP3ATM | |
| SCHEMBL4145473 | 0.92 | HDAC1 (0.63) | HDAC1HDAC6PARP1PARP3ATM | |
| SCHEMBL5966500 | 0.92 | HDAC1 (0.63) | HDAC1HDAC6PARP1PARP3ATM | |
| SCHEMBL4153061 | 0.89 | MDM4 (0.67) | HDAC1HDAC6PARP1PARP3ATM | |
| SCHEMBL4149820 | 0.89 | MDM4 (0.67) | HDAC1HDAC6PARP1PARP3ATM | |
| SCHEMBL4153058 | 0.89 | MDM4 (0.67) | HDAC1HDAC6PARP1PARP3ATM | |
| SCHEMBL4149824 | 0.89 | MDM4 (0.67) | HDAC1HDAC6PARP1PARP3ATM | |
| SCHEMBL9440322 | 0.87 | ITGB3 (0.61) | CTSGCMA1 | |
| SCHEMBL9440326 | 0.87 | ITGB3 (0.61) | CTSGCMA1 |
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-0526488-B1 | BENZYLPHOSPHONIC ACID TYROSINE KINASE INHIBITORS | PFIZER (US) | 1994-11-30 | — | — | EP | disclosed |
| US-5326905-A | Benzylphosphonic acid tyrosine kinase inhibitors | PFIZER INC. (US) | 1994-07-05 | — | — | US | disclosed |
| EP-0526488-A1 | BENZYLPHOSPHONIC ACID TYROSINE KINASE INHIBITORS. | PFIZER (US) | 1993-02-10 | — | — | EP | disclosed |