Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.73 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.73 |
| ▸ | LMNA | P02545 | 1/20 | 0.73 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.60 |
| ▸ | MEN1 | O00255 | 3/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 4/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | BRAF | P15056 | 1/20 | 0.50 |
| ▸ | CDC7 | O00311 | 2/20 | 0.49 |
| ▸ | DBF4 | Q9UBU7 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29783018 | 0.89 | CYP3A4 (0.77) | CYP1A2CYP3A4CYP2C19LMNAKMT2A | |
| SCHEMBL1574577 | 0.89 | CYP3A4 (0.77) | CYP1A2CYP3A4CYP2C19LMNAKMT2A | |
| Hydrochloric Acid SCHEMBL1679765 | 0.87 | CYP3A4 (0.75) | CYP1A2CYP3A4CYP2C19LMNAKMT2A | |
| SCHEMBL595294 | 0.86 | CYP1A2 (0.77) | CYP1A2CYP3A4CYP2C19LMNAKMT2A | |
| Hydrochloric Acid SCHEMBL11388179 | 0.84 | CYP1A2 (0.75) | CYP1A2CYP3A4CYP2C19LMNAKMT2A | |
| SCHEMBL5211666 | 0.84 | CYP1A2 (1.00) | CYP1A2CYP3A4CYP2C19LMNAKMT2A | |
| SCHEMBL3065347 | 0.84 | CYP1A2 (0.75) | CYP1A2CYP3A4CYP2C19LMNAKMT2A | |
| Hydrochloric Acid SCHEMBL11388173 | 0.83 | CYP1A2 (0.73) | CYP1A2CYP3A4CYP2C19LMNAKMT2A | |
| SCHEMBL11389733 | 0.83 | CYP1A2 (1.00) | CYP1A2CYP3A4CYP2C19LMNAKMT2A | |
| SCHEMBL10066961 | 0.83 | CYP3A4 (0.68) | CYP1A2CYP3A4CYP2C19LMNAKMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4260765-A | APHIDICIDES | UNIROYAL, INC. (US) | 1981-04-07 | — | — | US | disclosed |
| US-4080457-A | INSECTICIDES, PESTICIDES, MITICIDES | UNIROYAL CHEMICAL COMPANY, INC. | 1978-03-21 | — | — | US | disclosed |