Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4A | O75164 | 2/20 | 0.38 |
| ▸ | KDM5A | P29375 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | NT5E | P21589 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9824026 | 0.82 | CYP1A2 (0.44) | CYP3A4CYP1A2CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL10333953 | 0.80 | LMNA (0.40) | LMNAPKMCYP3A4CYP1A2CYP2D6 | |
| SCHEMBL9871573 | 0.80 | CYP3A4 (0.52) | LMNAPKMCYP3A4CYP1A2CYP2D6 | |
| SCHEMBL9823684 | 0.80 | CYP3A4 (0.41) | KDM4AKDM5ACYP3A4EPHX1ENPP2 | |
| SCHEMBL9823633 | 0.79 | EPHX1 (0.43) | KDM4AKDM5ACYP2C19EPHX1ENPP2 | |
| SCHEMBL9272650 | 0.78 | CYP3A4 (0.43) | LMNACYP3A4CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL9832648 | 0.77 | EPHX1 (0.46) | KDM4AKDM5ACYP2C19EPHX1ENPP2 | |
| SCHEMBL9022060 | 0.75 | CYP3A4 (0.45) | LMNACYP3A4CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL9203686 | 0.75 | CYP3A4 (0.41) | LMNACYP3A4CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL10726056 | 0.75 | CYP19A1 (0.50) | CYP3A4CYP1A2CYP2D6CYP2C19POLB |
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 |
|---|---|---|---|---|---|---|---|
| JP-1050863-A | — | — | None | — | — | JP | disclosed |
| EP-0301393-B1 | 1,4-DISUBSTITUTED 1-AZOLYL-3,3-DYMETHYLBUTANE DERIVATIVES | BAYER AG (DE) | 1991-08-14 | — | — | EP | disclosed |
| US-4968712-A | PHYTOPATHOGENS, AGRICULTURE | BAYER AKTIENGESELLSCHAFT (DE) | 1990-11-06 | — | — | US | disclosed |
| EP-0301393-A1 | 1,4-Disubstituted 1-azolyl-3,3-dymethylbutane derivatives | BAYER AG (DE) | 1989-02-01 | — | — | EP | disclosed |