Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | MGLL | Q99685 | 1/20 | 0.42 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MMP3 | P08254 | 1/20 | 0.39 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL67469 | 0.85 | ALDH1A1 (0.41) | KIF11ALDH1A1MAPK1HDAC2LMNA | |
| SCHEMBL26604311 | 0.77 | CA1 (0.48) | KIF11ALDH1A1TP53CA1MGLL | |
| SCHEMBL26604314 | 0.77 | CA1 (0.48) | KIF11ALDH1A1TP53CA1MGLL | |
| SCHEMBL9247757 | 0.76 | ALDH1A1 (0.43) | KIF11ALDH1A1TP53CA1MGLL | |
| SCHEMBL9954440 | 0.72 | NFE2L2 (0.44) | — | |
| Biphenyl SCHEMBL26134410 | 0.72 | KIF11 (0.56) | KIF11ALDH1A1PTPN5CYP1A2CYP3A4 | |
| SCHEMBL695690 | 0.72 | ALDH1A1 (0.50) | KIF11ALDH1A1TP53CA1MGLL | |
| SCHEMBL2606098 | 0.72 | ALDH1A1 (0.50) | KIF11ALDH1A1TP53CA1MGLL | |
| SCHEMBL9171323 | 0.71 | CA1 (0.62) | ALDH1A1TP53CA1MGLLCYP1A2 | |
| SCHEMBL2839493 | 0.71 | ALDH1A1 (0.56) | KIF11ALDH1A1TP53CA1MGLL |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1951917-A | Pyridinone derivatives for treatment of atherosclerosis | SMITHKLINE BEECHAM PLC (GB) | 2007-04-25 | — | — | CN | disclosed |
| CN-1280275-C | Pyridone derivatives for the treatment of atherosclerosis | SMITHKLINE BEECHAM PLC (GB) | 2006-10-18 | — | — | CN | disclosed |
| US-6855713-B2 | Benzimidazole derivatives, a process for their manufacture and use as a medicine | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2005-02-15 | — | — | US | disclosed |
| CN-1479724-A | Pyridone derivatives for the treatment of atherosclerosis | ʷ��˿�������ȳ�ķ����˾ | 2004-03-03 | — | — | CN | disclosed |