Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLA | P06280 | 1/20 | 0.81 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.81 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.61 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.61 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.61 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.61 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.61 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.61 |
| ▸ | TNKS | O95271 | 1/20 | 0.61 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.61 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.61 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.61 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.61 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.61 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.61 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | PLIN1 | O60240 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| Butenone SCHEMBL2961505 | 0.90 | GLA (0.91) | GLATDP1HDAC3HDAC4HDAC1 | |
| Butenone SCHEMBL312972 | 0.90 | TDP1 (1.00) | GLATDP1HDAC3HDAC4HDAC1 | |
| Butenone SCHEMBL76632 | 0.90 | TDP1 (1.00) | GLATDP1HDAC3HDAC4HDAC1 | |
| Butenone SCHEMBL12984182 | 0.90 | TDP1 (1.00) | GLATDP1HDAC3HDAC4HDAC1 | |
| Butenone SCHEMBL30740014 | 0.88 | GLA (0.88) | GLATDP1HDAC3HDAC4HDAC1 | |
| Butenone SCHEMBL792625 | 0.88 | TDP1 (0.95) | GLATDP1HDAC3HDAC4HDAC1 | |
| Butenone SCHEMBL7053850 | 0.88 | TDP1 (0.95) | GLATDP1HDAC3HDAC4HDAC1 | |
| Butenone SCHEMBL6235457 | 0.88 | TDP1 (0.95) | GLATDP1HDAC3HDAC4HDAC1 | |
| Butenone SCHEMBL4306181 | 0.88 | TDP1 (0.95) | GLATDP1HDAC3HDAC4HDAC1 | |
| Butenone SCHEMBL6401376 | 0.88 | TDP1 (0.95) | GLATDP1HDAC3HDAC4HDAC1 |
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-112542231-A | MapReduce and big data-based management method and system for number of cases for surgical prophylaxis | 杭州杏林信息科技有限公司 | 2021-03-23 | — | — | CN | disclosed |