Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | KCNA1 | Q09470 | 3/20 | 0.37 |
| ▸ | KCNAB1 | Q14722 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 6/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3498412 | 0.78 | FNTA (0.41) | MAPTTP53KCNA1KCNAB1ALDH1A1 | |
| SCHEMBL3502266 | 0.67 | FNTA (0.57) | ALDH1A1GAA | |
| Hydrochloric Acid SCHEMBL6635222 | 0.66 | FNTA (0.56) | ALDH1A1GAA | |
| SCHEMBL12360033 | 0.66 | EPHX2 (0.45) | MAPTKCNA1KCNAB1ALDH1A1GAA | |
| SCHEMBL12360115 | 0.64 | RORC (0.45) | TP53ALDH1A1GAARXRA | |
| SCHEMBL12359901 | 0.64 | TSHR (0.44) | MAPTTP53ALDH1A1SMN1; SMN2 | |
| SCHEMBL12360027 | 0.64 | NPC1 (0.44) | MAPTTP53ALDH1A1SMN1; SMN2 | |
| SCHEMBL13387653 | 0.63 | PKM (0.47) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL12360005 | 0.63 | KDM4E (0.44) | MAPTKDM4EBRD4 | |
| SCHEMBL12359750 | 0.63 | NLRP3 (0.39) | TP53GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-6455523-B1 | ADMINISTERING 1,4-BENZODIAZEPINE DERIVATIVE AS ANTITUMOR OR ANTICARCINOGENIC AGENT | BRISTOL-MYERS SQUIBB COMPANY | 2002-09-24 | — | — | US | disclosed |