Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | PRKCA | P17252 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | ALPL | P05186 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9796274 | 0.84 | NTRK1 (0.41) | KMT2AKDM4EGSK3BCYP1A2ALPL | |
| SCHEMBL9796452 | 0.84 | ATM (0.44) | TP53KMT2ASCN9AKDM4EPRKCA | |
| SCHEMBL9796539 | 0.84 | CREBBP (0.40) | KMT2ASCN9AKDM4EALDH1A1BRD4 | |
| SCHEMBL9796276 | 0.83 | ALDH1A1 (0.51) | SCN9APRKCAGSK3BCA2ALDH1A1 | |
| SCHEMBL9796185 | 0.83 | KDM4E (0.33) | TP53KMT2ASCN9AKDM4ECYP1A2 | |
| SCHEMBL9796571 | 0.81 | NR4A2 (0.41) | SCN9AGSK3BBRD4 | |
| SCHEMBL9796435 | 0.81 | PGR (0.45) | KMT2ASCN9AGSK3BALPLBRD4 | |
| SCHEMBL9796308 | 0.81 | SCN9A (0.42) | SCN9AGSK3BTSHR | |
| SCHEMBL6050601 | 0.81 | ALDH1A1 (0.45) | KMT2AKDM4ECA2ALDH1A1MEN1 | |
| SCHEMBL9796414 | 0.80 | CYP1A2 (0.32) | KMT2AKDM4ECYP1A2ALPLTSHR |
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-4997840-A | Quinolone sulphonates having antihypertensive activity | THE BOOTS COMPANY, PLC (GB) | 1991-03-05 | — | — | US | disclosed |
| EP-0330340-A1 | Therapeutic agents | The Boots Company PLC (GB) | 1989-08-30 | — | — | EP | disclosed |