Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 4/20 | 0.46 |
| ▸ | CES1 | P23141 | 5/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | SCN1A | P35498 | 3/20 | 0.39 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.39 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3251384 | 0.83 | CES1 (0.49) | CES1LMNASCN1ASCN2ASCN3A | |
| SCHEMBL7914713 | 0.81 | CES1 (0.44) | KIF11CES1LMNATSHRCES2 | |
| SCHEMBL1255415 | 0.80 | LMNA (0.50) | CES1LMNASCN1ASCN2ASCN3A | |
| SCHEMBL3729771 | 0.77 | LMNA (0.46) | CES1LMNASCN1ASCN2ASCN3A | |
| SCHEMBL14932471 | 0.75 | CES1 (0.44) | CES1LMNACYP3A4CYP2D6CYP2C19 | |
| SCHEMBL1260547 | 0.75 | CES1 (0.46) | KIF11CES1LMNAKMT2ACES2 | |
| SCHEMBL7911425 | 0.74 | CES1 (0.49) | CES1LMNACYP3A4CYP1A2CYP2D6 | |
| SCHEMBL5574740 | 0.74 | CES1 (0.49) | CES1LMNACYP3A4CYP2D6CYP2C19 | |
| SCHEMBL8234137 | 0.74 | CES1 (0.40) | KIF11CES1LMNATSHRMEN1 | |
| SCHEMBL868096 | 0.73 | CES1 (0.51) | CES1LMNACYP1A2CYP2D6CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998020878-A1 | 5-[φ-(SUBSTITUTED ARYL)ALKENYLENE AND ALKYNYLENE]-2,4-DIAMINOPYRIMIDINES AS PESTICIDES | FMC CORPORATION (US) | 1998-05-22 | — | — | WO | disclosed |