Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 5/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 6/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9465726 | 0.91 | CYP19A1 (0.40) | CYP19A1CYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL9465335 | 0.88 | CYP19A1 (0.44) | CYP19A1CYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL9466583 | 0.84 | CYP19A1 (0.36) | CYP19A1CYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL9465488 | 0.83 | CYP19A1 (0.35) | CYP19A1CYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL9465839 | 0.80 | CYP19A1 (0.41) | CYP19A1CYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL9466029 | 0.79 | CYP19A1 (0.35) | CYP19A1CYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL9467050 | 0.79 | CYP19A1 (0.48) | CYP19A1CYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL9466901 | 0.78 | CYP3A4 (0.34) | CYP19A1CYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL9465998 | 0.78 | CYP19A1 (0.43) | CYP19A1CYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL9466481 | 0.78 | CYP2C9 (0.40) | CYP19A1CYP2C9CYP2C19CYP3A4CYP2D6 |
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-5180827-A | Fungicide Intermediates | RHONE-POULENC AGROCHIMIE (FR) | 1993-01-19 | — | — | US | disclosed |
| US-4999357-A | Agricultural use, prevention and controlling | RHONE-POULENC AGROCHIMIE (FR) | 1991-03-12 | — | — | US | disclosed |