Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.33 |
| ▸ | WNT3A | P56704 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | AGER | Q15109 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.31 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3307343 | 0.76 | P2RX7 (0.39) | P2RX7CTNNB1WNT3AKDM4EMAPT | |
| SCHEMBL3307346 | 0.76 | P2RX7 (0.39) | P2RX7CTNNB1WNT3AKDM4EMAPT | |
| SCHEMBL3307340 | 0.76 | P2RX7 (0.39) | P2RX7CTNNB1WNT3AKDM4EMAPT | |
| SCHEMBL2320853 | 0.66 | P2RX7 (0.44) | P2RX7CTNNB1WNT3AKDM4EMAPT | |
| SCHEMBL3309984 | 0.66 | P2RX7 (0.37) | P2RX7CTNNB1WNT3AKDM4EMAPT | |
| SCHEMBL3309986 | 0.66 | P2RX7 (0.37) | P2RX7CTNNB1WNT3AKDM4EMAPT | |
| SCHEMBL7574223 | 0.65 | TSHR (0.35) | KDM4ETSHR | |
| SCHEMBL31141952 | 0.65 | AKT1 (0.44) | P2RX7CTNNB1WNT3AKDM4EMAPT | |
| SCHEMBL726451 | 0.64 | P2RX7 (0.46) | P2RX7CTNNB1WNT3AKDM4EMAPT | |
| SCHEMBL108190 | 0.62 | — | — |
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-2010047774-A2 | INHIBITORS OF MYCOBACTERIUM TUBERCULOSIS MALATE SYNTHASE, METHODS OF MARKING AND USES THEREOF | THE TEXAS A & M UNIVERSITY SYSTEM (US) | 2010-04-29 | — | — | WO | disclosed |