Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | MC5R | P33032 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | TERT | O14746 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HTR1D | P28221 | 1/20 | 0.42 |
| ▸ | HTR1B | P28222 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.41 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.41 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL23877653 | 0.95 | LMNA (0.48) | MAPK1MC5RALDH1A1HPGDTERT | |
| SCHEMBL28464377 | 0.83 | MC5R (0.46) | MAPK1MC5RHPGDTERTMEN1 | |
| SCHEMBL25195712 | 0.83 | ATM (0.46) | MAPK1MC5RALDH1A1MEN1KMT2A | |
| SCHEMBL5870343 | 0.81 | TERT (0.47) | MAPK1MC5RHPGDTERTMEN1 | |
| Hydrochloric Acid SCHEMBL25193498 | 0.79 | ATM (0.44) | ALDH1A1MEN1KMT2AHTR1DHTR1B | |
| SCHEMBL20962611 | 0.78 | ALDH1A1 (0.59) | ALDH1A1CA12CA2CA9LMNA | |
| SCHEMBL3297203 | 0.77 | PRMT5 (0.50) | ALDH1A1MEN1KMT2AHTR1DHTR1B | |
| SCHEMBL1456304 | 0.77 | ALDH1A1 (0.43) | ALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL1506818 | 0.76 | MC5R (0.47) | MAPK1MC5RALDH1A1HPGDTERT | |
| SCHEMBL136100 | 0.76 | ALDH1A1 (0.46) | MAPK1MC5RALDH1A1HPGDMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105764501-A | Compositions for improving the therapeutic benefit of bisantrene | 现代化制药公司 | 2016-07-13 | — | — | CN | claimed |
| CN-105764501-A | Compositions for improving the therapeutic benefit of bisantrene | 现代化制药公司 | 2016-07-13 | — | — | CN | disclosed |
| CN-105764502-A | Combination methods for improving the therapeutic benefit of bisantrene and analogs and derivatives thereof | 现代化制药公司 | 2016-07-13 | — | — | CN | disclosed |