Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SORT1 | Q99523 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.36 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.36 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.36 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.36 |
| ▸ | PYGL | P06737 | 1/20 | 0.35 |
| ▸ | FNTA | P49354 | 1/20 | 0.35 |
| ▸ | FNTB | P49356 | 1/20 | 0.35 |
| ▸ | PGGT1B | P53609 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | GRN | P28799 | 2/20 | 0.34 |
| ▸ | C3AR1 | Q16581 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7420893 | 0.89 | ALDH1A1 (0.41) | SORT1ALDH1A1CYP2C19MAPK1KDM4E | |
| SCHEMBL7416089 | 0.88 | ALOX5 (0.44) | SORT1ALOX5 | |
| SCHEMBL7427316 | 0.87 | SORT1 (0.46) | SORT1ALDH1A1CYP2C19MAPK1SLC9A1 | |
| SCHEMBL7427850 | 0.87 | SORT1 (0.39) | SORT1ALDH1A1CYP2C19MAPK1SLC9A1 | |
| SCHEMBL7421514 | 0.84 | ALDH1A1 (0.44) | SORT1ALDH1A1MAPK1KDM4EPOLB | |
| SCHEMBL7425626 | 0.83 | MAPK1 (0.47) | SORT1ALDH1A1MAPK1SLC9A1KDM4E | |
| SCHEMBL7419841 | 0.82 | KDM4E (0.44) | ALDH1A1TAS1R3TAS1R1KDM4E | |
| SCHEMBL7421684 | 0.82 | S1PR4 (0.40) | SORT1ALDH1A1CYP2C19MAPK1TAS1R3 | |
| SCHEMBL7424358 | 0.81 | PSEN1 (0.49) | SORT1ALDH1A1CYP2C19AKR1C3AKR1C2 | |
| SCHEMBL7429853 | 0.76 | NTSR1 (0.44) | ALDH1A1AKR1C3AKR1C2FNTAFNTB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002039997-A2 | ACE-2 MODULATING COMPOUNDS AND USE THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2002-05-23 | — | — | WO | claimed |
| WO-2002039997-A2 | ACE-2 MODULATING COMPOUNDS AND USE THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2002-05-23 | — | — | WO | disclosed |