Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.43 |
| ▸ | KIF11 | P52732 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | PNMT | P11086 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL78619 | 0.83 | HDAC4 (0.47) | CYP19A1KIF11ALDH1A1TSHRSCN5A | |
| SCHEMBL29441583 | 0.83 | HDAC4 (0.47) | CYP19A1KIF11ALDH1A1TSHRSCN5A | |
| SCHEMBL8137247 | 0.83 | ESR1 (0.50) | CYP19A1KIF11ALDH1A1TSHRSCN5A | |
| SCHEMBL7784232 | 0.82 | CYP19A1 (0.49) | CYP19A1KIF11ALDH1A1TSHRSCN5A | |
| SCHEMBL2241265 | 0.82 | ESR1 (0.46) | KIF11ALDH1A1TSHRMAPK1CYP3A4 | |
| SCHEMBL12811806 | 0.81 | ALDH1A1 (0.43) | CYP19A1KIF11ALDH1A1TSHRSCN5A | |
| SCHEMBL11469047 | 0.81 | CYP19A1 (0.43) | CYP19A1KIF11ALDH1A1TSHRSCN5A | |
| SCHEMBL7024331 | 0.80 | CYP19A1 (0.46) | CYP19A1KIF11ALDH1A1TSHRSCN5A | |
| SCHEMBL3096971 | 0.79 | CYP19A1 (0.42) | CYP19A1KIF11ALDH1A1TSHRSCN5A | |
| SCHEMBL21791918 | 0.79 | CYP19A1 (0.42) | CYP19A1KIF11ALDH1A1TSHRSCN5A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5712281-A | Insecticidal substituted-2,4-diamino-5,6,7,8-tetrahydroquinazolines | FMC CORPORATION (US) | 1998-01-27 | — | — | US | disclosed |
| US-5536725-A | Insecticidal substituted-2,4-diamino-5,6,7,8-tetrahydroquinazolines | FMC CORPORATION (US) | 1996-07-16 | — | — | US | disclosed |
| US-4133837-A | Preferential aliphatic halogenation of ar-substituted alkylbenzenes | THE DOW CHEMICAL COMPANY (US) | 1979-01-09 | — | — | US | disclosed |
| US-4133837-A | Preferential aliphatic halogenation of ar-substituted alkylbenzenes | THE DOW CHEMICAL COMPANY (US) | 1979-01-09 | — | — | US | disclosed |