Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.33 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | SORT1 | Q99523 | 3/20 | 0.33 |
| ▸ | ITGAV | P06756 | 1/20 | 0.32 |
| ▸ | TYR | P14679 | 1/20 | 0.32 |
| ▸ | GRN | P28799 | 2/20 | 0.32 |
| ▸ | PYGL | P06737 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | ELANE | P08246 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7425815 | 0.88 | GRN (0.43) | DHFRALDH1A1MAPK1SORT1TYR | |
| SCHEMBL7417292 | 0.84 | ALDH1A1 (0.34) | ALDH1A1CYP2C19TAS1R3TAS1R1MAPK1 | |
| SCHEMBL7429293 | 0.82 | SORT1 (0.34) | DHFRALDH1A1CYP2C19TAS1R3TAS1R1 | |
| SCHEMBL7423334 | 0.79 | DHFR (0.34) | DHFRALDH1A1CYP2C19TAS1R3TAS1R1 | |
| SCHEMBL7426920 | 0.77 | CTSK (0.38) | DHFRALDH1A1CYP2C19TAS1R3TAS1R1 | |
| SCHEMBL7419079 | 0.76 | BCHE (0.37) | ALDH1A1MAPK1KMT2AMEN1 | |
| SCHEMBL5869589 | 0.76 | NPPA (0.41) | ALDH1A1CYP2C19TAS1R3TAS1R1MMP2 | |
| SCHEMBL7417318 | 0.76 | CNR2 (0.40) | ALDH1A1SORT1GRN | |
| SCHEMBL7425011 | 0.74 | GRN (0.44) | ALDH1A1MAPK1SORT1TYRGRN | |
| SCHEMBL7419514 | 0.73 | FNTA (0.38) | ALDH1A1SORT1GRNKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002039997-A2 | ACE-2 MODULATING COMPOUNDS AND USE THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2002-05-23 | — | — | WO | claimed |