Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 1/20 | 0.58 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.53 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.50 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 4/20 | 0.48 |
| ▸ | PLG | P00747 | 1/20 | 0.48 |
| ▸ | PLAT | P00750 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.48 |
| ▸ | GABRP | O00591 | 1/20 | 0.48 |
| ▸ | GABRD | O14764 | 1/20 | 0.48 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.48 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.48 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.48 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.48 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.48 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.48 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.48 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.48 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL147243 | 1.00 | ACE (0.58) | ACEGABRR1AKR1C3AKR1C1LMNA | |
| SCHEMBL1286869 | 1.00 | ACE (0.58) | ACEGABRR1AKR1C3AKR1C1LMNA | |
| SCHEMBL147242 | 1.00 | ACE (0.58) | ACEGABRR1AKR1C3AKR1C1LMNA | |
| SCHEMBL22001630 | 1.00 | ACE (0.58) | ACEGABRR1AKR1C3AKR1C1LMNA | |
| SCHEMBL110580 | 1.00 | ACE (0.58) | ACEGABRR1AKR1C3AKR1C1LMNA | |
| SCHEMBL24906952 | 1.00 | ACE (0.58) | ACEGABRR1AKR1C3AKR1C1LMNA | |
| Hydrochloric Acid SCHEMBL4372281 | 0.97 | ACE (0.56) | ACEGABRR1AKR1C3AKR1C1LMNA | |
| SCHEMBL11544105 | 0.97 | ACE (0.56) | ACEGABRR1AKR1C3AKR1C1LMNA | |
| Bromide SCHEMBL9180235 | 0.97 | ACE (0.56) | ACEGABRR1AKR1C3AKR1C1LMNA | |
| SCHEMBL11133443 | 0.97 | ACE (0.56) | ACEGABRR1AKR1C3AKR1C1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3456719-A1 | COMPOUNDS AND THEIR METHODS OF USE | Agios Pharmaceuticals, Inc. (US) | 2019-03-20 | — | — | EP | disclosed |