Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.72 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.72 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.72 |
| ▸ | P2RX1 | P51575 | 8/20 | 0.61 |
| ▸ | KCNMA1 | Q12791 | 6/20 | 0.59 |
| ▸ | P2RX4 | Q99571 | 5/20 | 0.58 |
| ▸ | P2RX7 | Q99572 | 5/20 | 0.58 |
| ▸ | TMPRSS4 | Q9NRS4 | 6/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | KDR | P35968 | 2/20 | 0.50 |
| ▸ | AURKA | O14965 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.50 |
| ▸ | JAK2 | O60674 | 1/20 | 0.50 |
| ▸ | GMNN | O75496 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | EGFR | P00533 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL30771748 | 0.84 | TAS1R3 (0.80) | TAS1R3TAS1R1TAS1R2P2RX1KCNMA1 | |
| SCHEMBL18341199 | 0.84 | TAS1R3 (0.80) | TAS1R3TAS1R1TAS1R2P2RX1KCNMA1 | |
| SCHEMBL10226957 | 0.84 | TAS1R3 (1.00) | TAS1R3TAS1R1TAS1R2P2RX1KCNMA1 | |
| SCHEMBL30771731 | 0.84 | TAS1R3 (1.00) | TAS1R3TAS1R1TAS1R2P2RX1KCNMA1 | |
| SCHEMBL24460164 | 0.82 | TAS1R3 (0.76) | TAS1R3TAS1R1TAS1R2P2RX1KCNMA1 | |
| SCHEMBL31238369 | 0.79 | TAS1R3 (0.86) | TAS1R3TAS1R1TAS1R2P2RX1KCNMA1 | |
| SCHEMBL24460159 | 0.78 | P2RX1 (0.53) | TAS1R3TAS1R1TAS1R2P2RX1KCNMA1 | |
| SCHEMBL27786745 | 0.77 | TAS1R3 (0.72) | TAS1R3TAS1R1TAS1R2P2RX1KCNMA1 | |
| SCHEMBL30771744 | 0.76 | P2RX1 (1.00) | TAS1R3TAS1R1TAS1R2P2RX1KCNMA1 | |
| SCHEMBL18341391 | 0.76 | P2RX1 (1.00) | TAS1R3TAS1R1TAS1R2P2RX1KCNMA1 |
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-2022109148-A1 | SMALL MOLECULE INHIBITORS OF SARS-COV-2 INFECTIONS | THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES (US) | 2022-05-27 | — | — | WO | disclosed |