Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CDK9 | P50750 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | ABAT | P80404 | 1/20 | 0.39 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2664415 | 0.76 | — | — | |
| Benzene SCHEMBL28162617 | 0.74 | EPHX2 (0.70) | CYP3A4EPHX2TP53EPHX1TSHR | |
| SCHEMBL7634 | 0.74 | EPHX2 (0.70) | CYP3A4EPHX2TP53EPHX1TSHR | |
| SCHEMBL560448 | 0.73 | CYP1A2 (0.45) | CYP1A2CYP3A4EPHX2TP53EPHX1 | |
| SCHEMBL10784058 | 0.73 | EPHX2 (0.52) | L3MBTL1CYP1A2CYP3A4CYP2D6EPHX2 | |
| SCHEMBL27872143 | 0.72 | EPHX2 (0.42) | L3MBTL1CYP1A2CYP3A4CYP2D6EPHX2 | |
| Hydrochloric Acid SCHEMBL9156069 | 0.72 | EPHX2 (0.67) | CYP3A4EPHX2TP53EPHX1TSHR | |
| Water SCHEMBL9215017 | 0.72 | EPHX2 (0.67) | CYP3A4EPHX2TP53EPHX1TSHR | |
| Bromide SCHEMBL5706299 | 0.72 | EPHX2 (0.67) | CYP3A4EPHX2TP53EPHX1TSHR | |
| Fluoride SCHEMBL10885265 | 0.72 | EPHX2 (0.67) | CYP3A4EPHX2TP53EPHX1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-104220505-B | Fungicide formulations for plasticized PVC | LANXESS DEUTSCHLAND GMBH (DE) | 2016-06-01 | — | — | CN | claimed |
| CN-104220505-A | Fungicide formulations for plasticized pvc | LANXESS DEUTSCHLAND GMBH | 2014-12-17 | — | — | CN | claimed |
| CN-102471526-A | Polymers comprising heterocyclic 3-membered ring compounds and iodine-containing compounds | LANXESS DEUTSCHLAND GMBH | 2012-05-23 | — | — | CN | claimed |
| CN-102471526-A | Polymers comprising heterocyclic 3-membered ring compounds and iodine-containing compounds | LANXESS DEUTSCHLAND GMBH | 2012-05-23 | — | — | CN | disclosed |