Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.41 |
| ▸ | ME2 | P23368 | 1/20 | 0.40 |
| ▸ | ME1 | P48163 | 1/20 | 0.40 |
| ▸ | ME3 | Q16798 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SCN4A | P35499 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL197522 | 0.69 | CA1 (0.79) | TP53KDM4EMAPTCA12CA1 | |
| SCHEMBL6733562 | 0.69 | CA1 (0.79) | TP53KDM4EMAPTCA12CA1 | |
| SCHEMBL9151672 | 0.69 | CA1 (0.79) | TP53KDM4EMAPTCA12CA1 | |
| 1,4-Dimethoxybenzene SCHEMBL8489 | 0.66 | CA1 (1.00) | KDM4EMAPTCA12CA1CA2 | |
| 1,4-Dimethoxybenzene SCHEMBL21802643 | 0.66 | CA1 (1.00) | KDM4EMAPTCA12CA1CA2 | |
| SCHEMBL20323072 | 0.65 | CA1 (0.69) | TP53KDM4EMAPTCA12CA1 | |
| SCHEMBL338452 | 0.64 | CLK4 (0.64) | TP53KDM4EMAPTCA12CA1 | |
| SCHEMBL22112581 | 0.64 | MAPT (0.75) | TP53KDM4EMAPTCA12CA1 | |
| SCHEMBL21852751 | 0.64 | ALDH1A1 (0.67) | TP53KDM4EMAPTCA12CA1 | |
| SCHEMBL2696603 | 0.64 | CA12 (0.44) | TP53KDM4EMAPTCA12CA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1553900-A | Acylsemicarbazides as cyclin dependent kinase inhibitors useful as anti-cancer and anti-proliferative agents | ��ʱ��ʩ����ҩ��˾ | 2004-12-08 | — | — | CN | disclosed |