Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2163180 | 0.81 | LMNA (0.59) | RAB9AALDH1A1KDM4ETSHRLMNA | |
| SCHEMBL8925134 | 0.80 | NPC1 (0.51) | NPC1MAPTRAB9AALDH1A1GAA | |
| SCHEMBL28005130 | 0.79 | ALDH1A1 (0.66) | NPC1MAPTRAB9ACYP1A2ALDH1A1 | |
| SCHEMBL2090533 | 0.77 | ALDH1A1 (0.54) | NPC1MAPTRAB9AALDH1A1GAA | |
| SCHEMBL2056167 | 0.77 | ALDH1A1 (0.54) | NPC1MAPTRAB9AALDH1A1GAA | |
| SCHEMBL21270133 | 0.75 | CYP1A2 (0.73) | CYP1A2ALDH1A1GAALMNAPOLB | |
| SCHEMBL2094429 | 0.74 | ALDH1A1 (0.51) | NPC1MAPTRAB9AALDH1A1GAA | |
| SCHEMBL2094431 | 0.74 | ALDH1A1 (0.53) | NPC1MAPTRAB9AALDH1A1GAA | |
| Hydrochloric Acid SCHEMBL30496762 | 0.73 | KMT2A (0.47) | NPC1MAPTRAB9AALDH1A1LMNA | |
| SCHEMBL21270138 | 0.71 | CYP1A2 (0.67) | CYP1A2ALDH1A1SLC6A2SLC6A4SLC6A3 |
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 2 patents. 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 | disclosed |
| US-5073565-A | Atherosclerosis, anticholesterol | WARNER-LAMBERT COMPANY (US) | 1991-12-17 | — | — | US | disclosed |