Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | SCN1A | P35498 | 1/20 | 0.45 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.45 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.45 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | CPA1 | P15085 | 4/20 | 0.41 |
| ▸ | CPA3 | P15088 | 3/20 | 0.41 |
| ▸ | FOLH1 | Q04609 | 3/20 | 0.41 |
| ▸ | CPB1 | P15086 | 1/20 | 0.41 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9262746 | 0.90 | KMT2A (0.49) | MAPK1HIF1ACYP1A2SLC6A3TDP1 | |
| SCHEMBL7491183 | 0.88 | CYP1A2 (0.47) | CYP1A2CPA1CPA3FOLH1CPB1 | |
| SCHEMBL7490323 | 0.86 | CYP1A2 (0.46) | CYP1A2CPA1CPA3FOLH1CPB1 | |
| SCHEMBL9254477 | 0.83 | CYP1A2 (0.43) | CYP1A2KMT2ACPA1CPA3FOLH1 | |
| SCHEMBL9257787 | 0.83 | CYP1A2 (0.43) | CYP1A2CPA1CPA3FOLH1CPB1 | |
| SCHEMBL9259001 | 0.82 | CYP1A2 (0.47) | CYP1A2CPA1CPA3FOLH1CPB1 | |
| SCHEMBL9259162 | 0.82 | ACE2 (0.43) | CYP1A2CPA1CPA3FOLH1CPB1 | |
| SCHEMBL7493861 | 0.80 | CYP1A2 (0.54) | CYP1A2CPA1CPA3FOLH1CPB1 | |
| SCHEMBL9259935 | 0.80 | PTGES (0.40) | CYP1A2KMT2ACPA1CPA3FOLH1 | |
| SCHEMBL7277365 | 0.79 | CYP1A2 (0.59) | CYP1A2CPA1CPA3FOLH1CPB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5393875-A | Hypotensive, cardiotonic and antiischemic agents | HOFFMANN-LA ROCHE INC. (US) | 1995-02-28 | — | — | US | disclosed |