Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 6/20 | 0.64 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | GOT1 | P17174 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.33 |
| ▸ | WNT3A | P56704 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
| ▸ | SNCA | P37840 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL109491 | 0.78 | P2RX7 (1.00) | P2RX7AHRCES1GOT1KMT2A | |
| SCHEMBL21585663 | 0.77 | CES2 (0.52) | P2RX7CES1KMT2A | |
| SCHEMBL29374491 | 0.71 | — | — | |
| SCHEMBL667511 | 0.71 | — | — | |
| SCHEMBL8977638 | 0.71 | P2RX7 (0.61) | P2RX7AHRCES1GOT1KMT2A | |
| Hydrochloric Acid SCHEMBL17842884 | 0.70 | P2RX7 (0.60) | P2RX7AHRCES1GOT1KMT2A | |
| Formaldehyde SCHEMBL27859574 | 0.70 | P2RX7 (0.55) | P2RX7AHRCES1KMT2AMEN1 | |
| Water SCHEMBL30487780 | 0.70 | P2RX7 (0.60) | P2RX7AHRCES1GOT1KMT2A | |
| Hydrochloric Acid SCHEMBL28317610 | 0.70 | P2RX7 (0.60) | P2RX7AHRCES1GOT1KMT2A | |
| SCHEMBL27790761 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3802501-A1 | COMPOUNDS AS NUCLEAR TRANSPORT MODULATORS AND USES THEREOF | XW Laboratories Inc. (KY) | 2021-04-14 | — | — | EP | disclosed |
| WO-2019233447-A1 | COMPOUNDS AS NUCLEAR TRANSPORT MODULATORS AND USES THEREOF | XW LABORATORIES, INC. (CN) | 2019-12-12 | — | — | WO | disclosed |