Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR1 | P30556 | 3/20 | 0.45 |
| ▸ | AGTR2 | P50052 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.44 |
| ▸ | CASP7 | P55210 | 3/20 | 0.44 |
| ▸ | CASP1 | P29466 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | GAA | P10253 | 4/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11280553 | 0.93 | KDM4E (0.46) | AGTR1AGTR2KDM4EHSD17B10CASP7 | |
| SCHEMBL11269247 | 0.90 | KDM4E (0.49) | KDM4EHSD17B10CASP7CASP1ALDH1A1 | |
| SCHEMBL11268488 | 0.80 | ALDH1A1 (0.62) | KDM4EHSD17B10CASP7CASP1ALDH1A1 | |
| SCHEMBL11265870 | 0.77 | KDM4E (0.48) | KDM4EHSD17B10CASP7CASP1ALDH1A1 | |
| SCHEMBL11263778 | 0.74 | ALPG (0.58) | KDM4EHSD17B10CASP7CASP1ALDH1A1 | |
| Doqualast SCHEMBL124450 | 0.71 | KDM4E (0.63) | KDM4EHSD17B10CASP7CASP1ALDH1A1 | |
| SCHEMBL11261079 | 0.70 | ALPG (0.61) | KDM4EHSD17B10CASP7CASP1ALDH1A1 | |
| SCHEMBL10080478 | 0.70 | GRIN2D (0.55) | AGTR1AGTR2KDM4EALDH1A1CYP1A2 | |
| SCHEMBL11275840 | 0.69 | ALPG (0.61) | KDM4EHSD17B10CASP7CASP1ALDH1A1 | |
| SCHEMBL11617862 | 0.69 | ALPG (0.43) | KDM4EHSD17B10CASP7CASP1ALDH1A1 |
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-4348396-A | Substituted 11-oxo-11H-pyrido[2,1-b]quinazolines and method of inhibiting allergic reactions with them | HOFFMANN-LA ROCHE INC. (US) | 1982-09-07 | — | — | US | disclosed |