Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | THRB | P10828 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6137063 | 0.80 | HPGD (0.50) | HPGDPOLBALDH1A1THRBLMNA | |
| SCHEMBL26940812 | 0.69 | ALDH1A1 (0.52) | ALDH1A1THRBLMNAKMT2AMAPT | |
| SCHEMBL21348496 | 0.68 | ALDH1A1 (0.51) | ALDH1A1THRBLMNAKMT2AMAPT | |
| SCHEMBL7392882 | 0.66 | DRD4 (0.46) | ALDH1A1TSHRL3MBTL1SMN1; SMN2NPC1 | |
| SCHEMBL12123810 | 0.66 | POLB (0.66) | POLBALDH1A1THRBLMNAKMT2A | |
| SCHEMBL12123774 | 0.66 | ALDH1A1 (0.72) | HPGDPOLBALDH1A1LMNAKMT2A | |
| SCHEMBL21120553 | 0.65 | ALDH1A1 (0.54) | ALDH1A1THRBLMNAKMT2AMAPT | |
| SCHEMBL20333206 | 0.65 | ALDH1A1 (0.54) | ALDH1A1THRBLMNAKMT2AMAPT | |
| SCHEMBL26579740 | 0.65 | ALDH1A1 (0.54) | ALDH1A1THRBLMNAKMT2AMAPT | |
| Hydrochloric Acid SCHEMBL7932172 | 0.65 | ALDH1A1 (0.70) | HPGDPOLBALDH1A1THRBLMNA |
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-106456662-A | Compositions of pentosan polysulfate for oral administration and methods of use thereof | 奥利金制药公司 | 2017-02-22 | — | — | CN | claimed |